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Receptor

PDB id	Resolution	Class	Description	Source	Keywords
5EQ1	1.55 Å	NON-ENZYME: OTHER	CRYSTAL STRUCTURE OF THE HUMAN BRPF1 BROMODOMAIN IN COMPLEX SEED12	HOMO SAPIENS	BROMODOMAIN AND PHD FINGER-CONTAINING PROTEIN 1(BRPF1) MONOLEUKEMIA ZINC-FINGER (MOZ) INHIBITOR TRANSCRIPTION DNA BPROTEIN
Ref.:	TWENTY CRYSTAL STRUCTURES OF BROMODOMAIN AND PHD FI CONTAINING PROTEIN 1 (BRPF1)/LIGAND COMPLEXES REVEA CONSERVED BINDING MOTIFS AND RARE INTERACTIONS. J.MED.CHEM. V. 59 5555 2016

Ligand

Ligand	Chain:Residue	Validity	Ligand Warnings	Binding Data	NGL Viewer	Molecular Weight (Da)	Formula	SMILES
NO3	A:802;	Invalid;	none;	submit data		62.005	N O3	[N+](...
BEA	A:801;	Valid;	none;	Kd = 21 uM		190.245	C9 H8 N3 S	Cc1cc...

View in 3D viewer

90% Homology Family

Leader

PDB id	Resolution	Class	Description	Source	Keywords
4UYE	1.65 Å	NON-ENZYME: OTHER	BROMODOMAIN OF HUMAN BRPF1 WITH N-1,3-DIMETHYL-2-OXO-6-( PIPERIDIN-1-YL)-2,3-DIHYDRO-1H-1,3-BENZODIAZOL-5-YL-2- M ETHOXYBENZAMIDE	HOMO SAPIENS	TRANSCRIPTION INHIBITOR HISTONE EPIGENETIC READER ANTAGO
Ref.:	1,3-DIMETHYL BENZIMIDAZOLONES ARE POTENT, SELECTIVE INHIBITORS OF THE BRPF1 BROMODOMAIN. ACS MED.CHEM.LETT. V. 5 1190 2014

Members (37)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 1610 families.
1	5E3G	-	5JQ	C5 H4 N4 O2 S	C12=C(NC(=....
2	5T4U	ic50 = 4800 nM	12Q	C10 H9 N O	CN1c2ccccc....
3	5EWH	Kd = 170 uM	5SG	C9 H7 N O	c1cc2cnccc....
4	5C85	Kd = 105 uM	4YO	C8 H7 Br N2 O	c1cc2c(cc1....
5	5E3D	Kd = 95 uM	5JL	C5 H4 N4 O S2	C12=C(NC(=....
6	5C87	-	4YS	C9 H7 N O	c1ccc2c(c1....
7	5O4T	-	9KT	C10 H10 N2 O2	CN1c2ccccc....
8	5OV8	Kd = 18 uM	AXN	C24 H30 N4 O4 S	CC(C)Cc1cc....
9	5O4S	ic50 = 3.4 uM	9KW	C24 H28 N4 O5 S	CN1c2cc(c(....
10	5MWH	Kd = 1.8 uM	UWX	C24 H30 N4 O5 S	CC(C)Cc1cc....
11	5DY7	-	5GT	C9 H7 F3 N2 O	c1cc2c(cc1....
12	5T4V	ic50 = 60 nM	N48	C19 H17 N3 O4 S	CC1=CC(=O)....
13	5DYC	-	5GU	C8 H7 Br N2 O	c1cc2c(cc1....
14	5O55	-	9L5	C19 H23 N5 O2	CCN1c2ccc(....
15	5EQ1	Kd = 21 uM	BEA	C9 H8 N3 S	Cc1cccc2c1....
16	5G4S	ic50 = 1 uM	8VI	C24 H31 N5 O3	CCN(c1cc2c....
17	5EWC	-	5SJ	C12 H14 N2 O3	CCOC(=O)c1....
18	5EPR	Kd = 91 uM	5QY	C9 H10 N2 O	C[C@H]1C(=....
19	5EVA	-	5S9	C11 H9 F2 N3 O	Cn1c(ccn1)....
20	5ETD	-	5RN	C10 H9 N O	CC(=O)c1c[....
21	5DYA	-	5GV	C11 H12 N2 O3	CC[C@@H]1C....
22	5EV9	-	5SB	C14 H12 N4 O	CC(=O)Nc1c....
23	5MYG	Kd = 31 nM	LS8	C19 H17 N3 O4 S	CC1=Cc2cc(....
24	5MWZ	Kd = 7.1 uM	KGU	C24 H36 N6 O3	CCN1c2cc(c....
25	5G4R	ic50 = 7.943 nM	LF1	C22 H27 N5 O3	C[C@@H]1CN....
26	5OWA	Kd = 3.5 uM	B0H	C17 H24 N4 O2 S	Cc1c(oc(n1....
27	5EM3	-	5Q0	C9 H7 N O	c1cc2c(ccc....
28	5ETB	Kd = 29 uM	5RO	C11 H11 N O	Cc1cccc2c1....
29	4UYE	Kd = 9.54 nM	9F9	C22 H26 N4 O3	CN1c2cc(c(....
30	5O5F	-	9LT	C22 H20 F N5 O3	CCN1c2ccc(....
31	5O5A	-	9LN	C22 H21 N5 O3	CCN1c2ccc(....
32	5O5H	-	9LK	C17 H14 Cl N3 O3	Cc1c(oc(n1....
33	5C7N	Kd = 0.27 uM	BMF	C17 H20 N6 O4 S	CCOC(=O)Nc....
34	5EPS	Kd = 38 uM	5QX	C9 H10 N2 O	CN1c2ccccc....
35	5MWG	ic50 = 1.7 uM	WGX	C25 H30 N4 O4 S	CN1c2cc(c(....
36	5D7X	Kd = 15 uM	XZ8	C14 H13 N3 O2	CC1=C(C(=O....
37	6EKQ	Kd = 10.9 uM	B0H	C17 H24 N4 O2 S	Cc1c(oc(n1....

70% Homology Family (39)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 1331 families.
1	5E3G	-	5JQ	C5 H4 N4 O2 S	C12=C(NC(=....
2	5T4U	ic50 = 4800 nM	12Q	C10 H9 N O	CN1c2ccccc....
3	5EWH	Kd = 170 uM	5SG	C9 H7 N O	c1cc2cnccc....
4	5C85	Kd = 105 uM	4YO	C8 H7 Br N2 O	c1cc2c(cc1....
5	5E3D	Kd = 95 uM	5JL	C5 H4 N4 O S2	C12=C(NC(=....
6	5C87	-	4YS	C9 H7 N O	c1ccc2c(c1....
7	5O4T	-	9KT	C10 H10 N2 O2	CN1c2ccccc....
8	5OV8	Kd = 18 uM	AXN	C24 H30 N4 O4 S	CC(C)Cc1cc....
9	5O4S	ic50 = 3.4 uM	9KW	C24 H28 N4 O5 S	CN1c2cc(c(....
10	5MWH	Kd = 1.8 uM	UWX	C24 H30 N4 O5 S	CC(C)Cc1cc....
11	5DY7	-	5GT	C9 H7 F3 N2 O	c1cc2c(cc1....
12	5T4V	ic50 = 60 nM	N48	C19 H17 N3 O4 S	CC1=CC(=O)....
13	5DYC	-	5GU	C8 H7 Br N2 O	c1cc2c(cc1....
14	5O55	-	9L5	C19 H23 N5 O2	CCN1c2ccc(....
15	5EQ1	Kd = 21 uM	BEA	C9 H8 N3 S	Cc1cccc2c1....
16	5G4S	ic50 = 1 uM	8VI	C24 H31 N5 O3	CCN(c1cc2c....
17	5EWC	-	5SJ	C12 H14 N2 O3	CCOC(=O)c1....
18	5EPR	Kd = 91 uM	5QY	C9 H10 N2 O	C[C@H]1C(=....
19	5EVA	-	5S9	C11 H9 F2 N3 O	Cn1c(ccn1)....
20	5ETD	-	5RN	C10 H9 N O	CC(=O)c1c[....
21	5DYA	-	5GV	C11 H12 N2 O3	CC[C@@H]1C....
22	5EV9	-	5SB	C14 H12 N4 O	CC(=O)Nc1c....
23	5MYG	Kd = 31 nM	LS8	C19 H17 N3 O4 S	CC1=Cc2cc(....
24	5MWZ	Kd = 7.1 uM	KGU	C24 H36 N6 O3	CCN1c2cc(c....
25	5G4R	ic50 = 7.943 nM	LF1	C22 H27 N5 O3	C[C@@H]1CN....
26	5OWA	Kd = 3.5 uM	B0H	C17 H24 N4 O2 S	Cc1c(oc(n1....
27	5EM3	-	5Q0	C9 H7 N O	c1cc2c(ccc....
28	5ETB	Kd = 29 uM	5RO	C11 H11 N O	Cc1cccc2c1....
29	4UYE	Kd = 9.54 nM	9F9	C22 H26 N4 O3	CN1c2cc(c(....
30	5O5F	-	9LT	C22 H20 F N5 O3	CCN1c2ccc(....
31	5O5A	-	9LN	C22 H21 N5 O3	CCN1c2ccc(....
32	5O5H	-	9LK	C17 H14 Cl N3 O3	Cc1c(oc(n1....
33	5C7N	Kd = 0.27 uM	BMF	C17 H20 N6 O4 S	CCOC(=O)Nc....
34	5EPS	Kd = 38 uM	5QX	C9 H10 N2 O	CN1c2ccccc....
35	5MWG	ic50 = 1.7 uM	WGX	C25 H30 N4 O4 S	CN1c2cc(c(....
36	5D7X	Kd = 15 uM	XZ8	C14 H13 N3 O2	CC1=C(C(=O....
37	6EKQ	Kd = 10.9 uM	B0H	C17 H24 N4 O2 S	Cc1c(oc(n1....
38	3RCW	-	MB3	C5 H9 N O	CN1CCCC1=O
39	5N49	ic50 = 450 nM	8LW	C22 H17 N3 O3	Cc1cc2c(cc....

50% Homology Family (64)

No:	PDB id	Binding Data	Representative ligand	Formula	Smiles
The Class containing this family consists of a total of 1144 families.
1	5I7Y	Kd = 52 nM	69G	C20 H21 N3 O2	C/C=C/CN1C....
2	4UIW	ic50 = 0.00000001 M	H1B	C22 H22 F3 N3 O3 S2	CCN1C=C(c2....
3	4UIV	ic50 = 0.00000001 M	XZB	C21 H20 F3 N3 O3 S2	CN1C=C(c2c....
4	5JI8	Kd = 23.4 uM	6KT	C8 H7 N3 O S	c1cc2c(cc1....
5	5MKY	ic50 = 2 uM	I0D	C15 H17 Cl N4 O	CN1CCc2c(c....
6	4UIU	ic50 = 0.00000001 M	TVU	C22 H24 N2 O6 S2	CN1C=C(c2c....
7	4UIT	ic50 = 0.00000001 M	N1D	C22 H25 N3 O6 S2	CN1C=C(c2c....
8	5I40	ic50 = 13.7 uM	67N	C8 H8 N2 O	CN1C=Cc2cc....
9	5I7X	Kd = 53 nM	67B	C17 H17 N3 O2	CN1C=C(c2c....
10	6V1B	Kd = 37 nM	H1B	C22 H22 F3 N3 O3 S2	CCN1C=C(c2....
11	6V0X	Kd = 277 uM	B49	C22 H27 F N4 O2	CCN(CC)CCN....
12	4XY8	Kd = 397 nM	43U	C12 H10 Br N5 O	COc1ccc(cc....
13	5IGM	Kd = 41.7 nM	BMF	C17 H20 N6 O4 S	CCOC(=O)Nc....
14	4Z6H	Kd = 612 nM	4L2	C16 H18 N2 O2	CC1=CC(=O)....
15	6HM0	Kd = 73 nM	GBW	C50 H64 N8 O9 S	Cc1c(scn1)....
16	5F1H	Kd = 14.1 nM	5U6	C20 H23 N3 O3	CN1C=C(c2c....
17	5F1L	ic50 = 21 nM	5U2	C19 H24 N2 O4	CC1=CC(=CN....
18	5F25	Kd = 9.1 uM	5TU	C14 H14 N2 O2	CC1=CC(=CN....
19	4Z6I	-	4L3	C27 H31 N3 O4	CC1=CC(=O)....
20	6V0S	Kd = 16000 nM	EAE	C13 H15 N O2 S	CCN1c2cc(c....
21	5EU1	Kd = 15.4 nM	5SW	C20 H23 N3 O3	CN1C=C(c2c....
22	6V14	Kd = 82 nM	QMG	C20 H19 N3 O2	Cc1ccc(cc1....
23	5F2P	Kd = 37.5 uM	5TY	C10 H12 N4 O	CN1C=Cc2c(....
24	5E3D	Kd = 95 uM	5JL	C5 H4 N4 O S2	C12=C(NC(=....
25	5C87	-	4YS	C9 H7 N O	c1ccc2c(c1....
26	5O4T	-	9KT	C10 H10 N2 O2	CN1c2ccccc....
27	5OV8	Kd = 18 uM	AXN	C24 H30 N4 O4 S	CC(C)Cc1cc....
28	5O4S	ic50 = 3.4 uM	9KW	C24 H28 N4 O5 S	CN1c2cc(c(....
29	5MWH	Kd = 1.8 uM	UWX	C24 H30 N4 O5 S	CC(C)Cc1cc....
30	5DY7	-	5GT	C9 H7 F3 N2 O	c1cc2c(cc1....
31	5T4V	ic50 = 60 nM	N48	C19 H17 N3 O4 S	CC1=CC(=O)....
32	5DYC	-	5GU	C8 H7 Br N2 O	c1cc2c(cc1....
33	5O55	-	9L5	C19 H23 N5 O2	CCN1c2ccc(....
34	5EQ1	Kd = 21 uM	BEA	C9 H8 N3 S	Cc1cccc2c1....
35	5G4S	ic50 = 1 uM	8VI	C24 H31 N5 O3	CCN(c1cc2c....
36	5EWC	-	5SJ	C12 H14 N2 O3	CCOC(=O)c1....
37	5EPR	Kd = 91 uM	5QY	C9 H10 N2 O	C[C@H]1C(=....
38	5EVA	-	5S9	C11 H9 F2 N3 O	Cn1c(ccn1)....
39	5ETD	-	5RN	C10 H9 N O	CC(=O)c1c[....
40	5DYA	-	5GV	C11 H12 N2 O3	CC[C@@H]1C....
41	5EV9	-	5SB	C14 H12 N4 O	CC(=O)Nc1c....
42	5MYG	Kd = 31 nM	LS8	C19 H17 N3 O4 S	CC1=Cc2cc(....
43	5MWZ	Kd = 7.1 uM	KGU	C24 H36 N6 O3	CCN1c2cc(c....
44	5G4R	ic50 = 7.943 nM	LF1	C22 H27 N5 O3	C[C@@H]1CN....
45	5OWA	Kd = 3.5 uM	B0H	C17 H24 N4 O2 S	Cc1c(oc(n1....
46	5EM3	-	5Q0	C9 H7 N O	c1cc2c(ccc....
47	5ETB	Kd = 29 uM	5RO	C11 H11 N O	Cc1cccc2c1....
48	4UYE	Kd = 9.54 nM	9F9	C22 H26 N4 O3	CN1c2cc(c(....
49	5O5F	-	9LT	C22 H20 F N5 O3	CCN1c2ccc(....
50	5O5A	-	9LN	C22 H21 N5 O3	CCN1c2ccc(....
51	5O5H	-	9LK	C17 H14 Cl N3 O3	Cc1c(oc(n1....
52	5C7N	Kd = 0.27 uM	BMF	C17 H20 N6 O4 S	CCOC(=O)Nc....
53	5EPS	Kd = 38 uM	5QX	C9 H10 N2 O	CN1c2ccccc....
54	5MWG	ic50 = 1.7 uM	WGX	C25 H30 N4 O4 S	CN1c2cc(c(....
55	5D7X	Kd = 15 uM	XZ8	C14 H13 N3 O2	CC1=C(C(=O....
56	6EKQ	Kd = 10.9 uM	B0H	C17 H24 N4 O2 S	Cc1c(oc(n1....
57	6V1E	Kd = 121 nM	5SW	C20 H23 N3 O3	CN1C=C(c2c....
58	6V17	Kd = 148 nM	H1B	C22 H22 F3 N3 O3 S2	CCN1C=C(c2....
59	6V0Q	Kd = 4200 nM	EAE	C13 H15 N O2 S	CCN1c2cc(c....
60	6V1H	Kd = 114 nM	BMF	C17 H20 N6 O4 S	CCOC(=O)Nc....
61	6V16	Kd = 556 nM	QMG	C20 H19 N3 O2	Cc1ccc(cc1....
62	6V1F	Kd = 418 nM	5U6	C20 H23 N3 O3	CN1C=C(c2c....
63	3RCW	-	MB3	C5 H9 N O	CN1CCCC1=O
64	5N49	ic50 = 450 nM	8LW	C22 H17 N3 O3	Cc1cc2c(cc....

Polypharmacology

Similar Ligands (2D)

Ligand no: 1; Ligand: BEA; Similar ligands found: 1

No:	Ligand	ECFP6 Tc	MDL keys Tc
1	BEA	1	1

Similar Ligands (3D)

Ligand no: 1; Ligand: BEA; Similar ligands found: 1112

No:	Ligand	Similarity coefficient
1	0P6	0.9742
2	ZYR	0.9740
3	8CM	0.9739
4	KUF	0.9717
5	AZ9	0.9684
6	97T	0.9680
7	CWS	0.9672
8	TTL	0.9655
9	J9Q	0.9653
10	N8Y	0.9648
11	TTY	0.9636
12	0N7	0.9633
13	BDP	0.9629
14	FDR	0.9624
15	5QX	0.9623
16	9FL	0.9617
17	B60	0.9607
18	M2K	0.9606
19	12Q	0.9605
20	HQD	0.9598
21	XHP	0.9595
22	7W1	0.9591
23	8HC	0.9587
24	5RO	0.9587
25	2FQ	0.9581
26	EA1	0.9576
27	OTW	0.9574
28	B62	0.9574
29	HQT	0.9570
30	MAQ	0.9569
31	BGC	0.9565
32	86J	0.9560
33	0FO	0.9557
34	44W	0.9556
35	DQU	0.9553
36	3PF	0.9544
37	0FK	0.9543
38	DNF	0.9542
39	COU	0.9540
40	9CA	0.9534
41	APZ	0.9530
42	52C	0.9530
43	1IT	0.9529
44	URC	0.9529
45	03V	0.9526
46	92K	0.9520
47	5RN	0.9519
48	15N	0.9519
49	4FS	0.9515
50	PH2	0.9512
51	DIN	0.9508
52	ICO	0.9506
53	OCH	0.9499
54	A7W	0.9498
55	GCS	0.9497
56	9KT	0.9496
57	KT7	0.9496
58	CLZ	0.9493
59	67N	0.9493
60	6ME	0.9493
61	2AQ	0.9492
62	GVG	0.9489
63	Z5P	0.9486
64	MVN	0.9485
65	JB5	0.9484
66	G3F	0.9484
67	JG8	0.9483
68	VNL	0.9483
69	AZ8	0.9481
70	PEY	0.9480
71	TEP	0.9479
72	MUA	0.9478
73	AJV	0.9477
74	SKA	0.9476
75	CH9	0.9476
76	4JQ	0.9474
77	2D0	0.9473
78	173	0.9471
79	209	0.9469
80	TOF	0.9465
81	2HQ	0.9463
82	LI6	0.9463
83	KJH	0.9463
84	ES5	0.9461
85	H42	0.9458
86	5QY	0.9456
87	15L	0.9454
88	AJ2	0.9453
89	0HO	0.9453
90	3Z8	0.9452
91	0JD	0.9450
92	GCU	0.9450
93	PXL	0.9449
94	44V	0.9447
95	0HN	0.9447
96	M1A	0.9444
97	IV2	0.9442
98	E7Z	0.9442
99	Q24	0.9438
100	D48	0.9438
101	ES0	0.9437
102	4RU	0.9436
103	BTY	0.9431
104	NID	0.9431
105	M6N	0.9428
106	MQN	0.9427
107	DPZ	0.9426
108	G3E	0.9426
109	5OB	0.9422
110	8S0	0.9421
111	XAZ	0.9420
112	DHB	0.9420
113	Q88	0.9420
114	M5K	0.9418
115	4HC	0.9414
116	GJP	0.9412
117	1HN	0.9411
118	1SQ	0.9411
119	AQO	0.9410
120	SE2	0.9409
121	J9W	0.9408
122	5WV	0.9407
123	JLZ	0.9407
124	4NC	0.9405
125	PYQ	0.9405
126	CWM	0.9404
127	2HU	0.9403
128	XX2	0.9401
129	MRW	0.9400
130	2ZM	0.9397
131	75K	0.9397
132	HHR	0.9397
133	GLC	0.9397
134	E1T	0.9395
135	5NI	0.9395
136	MEW	0.9390
137	7HQ	0.9389
138	PE0	0.9388
139	8ZE	0.9387
140	INO	0.9385
141	CFF	0.9384
142	4AA	0.9382
143	J5I	0.9382
144	ESI	0.9382
145	M1Q	0.9380
146	PRF	0.9379
147	1NP	0.9377
148	GDE	0.9376
149	NNO	0.9374
150	B57	0.9373
151	MYJ	0.9372
152	H33	0.9372
153	4YO	0.9372
154	5WY	0.9372
155	4A3	0.9370
156	5SG	0.9369
157	5Q0	0.9369
158	5CU	0.9369
159	CTL	0.9367
160	FHB	0.9366
161	NDM	0.9366
162	1LM	0.9365
163	2AK	0.9365
164	7NI	0.9365
165	RXA	0.9363
166	A29	0.9363
167	6NT	0.9362
168	0TU	0.9362
169	ISN	0.9362
170	5IQ	0.9361
171	7ZE	0.9361
172	2KA	0.9361
173	24W	0.9361
174	NTZ	0.9361
175	KKN	0.9360
176	2K8	0.9360
177	JBH	0.9359
178	INE	0.9359
179	4YS	0.9359
180	1LQ	0.9359
181	2HO	0.9358
182	ES1	0.9358
183	3ID	0.9357
184	DOB	0.9355
185	UFO	0.9354
186	5JQ	0.9353
187	PIM	0.9353
188	QX4	0.9351
189	NQ	0.9350
190	1F1	0.9349
191	8TX	0.9349
192	HQY	0.9348
193	32X	0.9347
194	6RQ	0.9346
195	JPZ	0.9344
196	4KL	0.9342
197	I3A	0.9341
198	ES7	0.9340
199	3NY	0.9340
200	VK3	0.9340
201	FA0	0.9340
202	6NI	0.9339
203	0W8	0.9338
204	93K	0.9334
205	HJP	0.9334
206	DBH	0.9333
207	3HA	0.9332
208	3F0	0.9331
209	P9P	0.9331
210	MSR	0.9331
211	39O	0.9330
212	LT2	0.9330
213	N2I	0.9325
214	5VL	0.9325
215	4MU	0.9324
216	3HM	0.9323
217	3A9	0.9323
218	VXX	0.9323
219	4P5	0.9322
220	3M0	0.9319
221	B55	0.9319
222	XQ0	0.9318
223	N5J	0.9318
224	ET2	0.9317
225	FOT	0.9317
226	FE DB1	0.9316
227	7W4	0.9316
228	2ZQ	0.9316
229	ABI	0.9315
230	8WT	0.9313
231	4Z4	0.9312
232	92P	0.9311
233	4M0	0.9311
234	0F9	0.9311
235	7B3	0.9311
236	FDB	0.9310
237	BHA	0.9310
238	TT4	0.9310
239	5RG	0.9308
240	FBB	0.9306
241	GTQ	0.9304
242	Q6T	0.9302
243	JAW	0.9302
244	BZ3	0.9296
245	5NU	0.9295
246	5XC	0.9294
247	DMD	0.9294
248	BZ2	0.9293
249	3IT	0.9293
250	X8D	0.9290
251	4TU	0.9290
252	4XH	0.9290
253	CHB	0.9289
254	1P7	0.9289
255	28N	0.9289
256	PQ0	0.9288
257	SOR	0.9287
258	Q71	0.9286
259	PIY	0.9285
260	4JT	0.9284
261	SYV	0.9283
262	MS9	0.9281
263	XIY	0.9280
264	R8V	0.9280
265	N3W	0.9280
266	3WA	0.9279
267	QBK	0.9279
268	HIS	0.9279
269	ZVO	0.9278
270	8WO	0.9276
271	C2Y	0.9275
272	2BG	0.9270
273	DNA	0.9270
274	HHS	0.9267
275	UNC	0.9267
276	NDH	0.9265
277	NOJ	0.9265
278	9R5	0.9263
279	30G	0.9263
280	K2T	0.9262
281	KJU	0.9261
282	6BL	0.9260
283	8W9	0.9260
284	HKD	0.9260
285	HA5	0.9259
286	EVA	0.9258
287	GAL	0.9257
288	HQJ	0.9256
289	9TW	0.9250
290	37T	0.9250
291	680	0.9248
292	4ME	0.9248
293	2LY	0.9246
294	KTW	0.9246
295	CLW	0.9246
296	36R	0.9245
297	EQT	0.9245
298	SLS	0.9244
299	2FY	0.9243
300	27B	0.9243
301	JBQ	0.9242
302	DHK	0.9242
303	RM1	0.9241
304	12T	0.9240
305	AN3	0.9240
306	PJW	0.9239
307	2EC	0.9238
308	LGC	0.9237
309	AKH	0.9236
310	42C	0.9235
311	HH8	0.9235
312	15E	0.9235
313	9FE	0.9233
314	TGX	0.9230
315	DHQ	0.9230
316	ABV	0.9229
317	344	0.9228
318	N2Z	0.9228
319	AZA	0.9228
320	9MG	0.9228
321	IJZ	0.9227
322	L5V	0.9225
323	PHB	0.9224
324	NCT	0.9223
325	TZF	0.9222
326	Q77	0.9222
327	AA	0.9221
328	CTS	0.9221
329	6TZ	0.9221
330	ONR	0.9220
331	FLV	0.9220
332	SHG	0.9220
333	SKM	0.9217
334	QSB	0.9216
335	DRL	0.9215
336	6CS	0.9214
337	1M2	0.9212
338	KDV	0.9210
339	QX2	0.9208
340	GTR	0.9208
341	2F6	0.9205
342	ES2	0.9204
343	AX7	0.9203
344	ICB	0.9203
345	GRE	0.9200
346	HHA	0.9200
347	BPY	0.9200
348	TWO	0.9199
349	5M0	0.9198
350	6M1	0.9198
351	5NE	0.9197
352	TIY	0.9196
353	7VS	0.9195
354	H5B	0.9194
355	UAN	0.9194
356	HNQ	0.9193
357	ADZ	0.9193
358	NPO	0.9193
359	SWA	0.9193
360	9DG	0.9192
361	226	0.9192
362	54G	0.9191
363	PHH	0.9191
364	495	0.9191
365	CPZ	0.9191
366	GCB	0.9190
367	5JL	0.9189
368	8IG	0.9189
369	4WL	0.9185
370	GUN	0.9185
371	270	0.9184
372	8NX	0.9184
373	SAL	0.9184
374	XM0	0.9184
375	8XQ	0.9183
376	4M4	0.9183
377	JUG	0.9178
378	AY4	0.9177
379	TH7	0.9177
380	PAB	0.9177
381	SHA	0.9176
382	MWP	0.9176
383	LKA	0.9175
384	MT0	0.9174
385	PDC	0.9174
386	1KP	0.9173
387	7VJ	0.9173
388	G5V	0.9172
389	CFP	0.9172
390	1P8	0.9170
391	ANF	0.9170
392	EN1	0.9170
393	V55	0.9166
394	JAE	0.9166
395	5GU	0.9165
396	F0J	0.9164
397	FGZ	0.9164
398	BZX	0.9163
399	F12	0.9163
400	IGA	0.9162
401	AJY	0.9161
402	KYA	0.9160
403	94W	0.9159
404	F31	0.9159
405	2MI	0.9156
406	QWW	0.9156
407	Q7A	0.9155
408	JTH	0.9155
409	SXS	0.9154
410	1A7	0.9153
411	QUZ	0.9153
412	JDN	0.9152
413	IHB	0.9152
414	TBS	0.9152
415	GXY	0.9151
416	NIZ	0.9151
417	IFP	0.9150
418	ODO	0.9150
419	R9Y	0.9150
420	K17	0.9149
421	QPR	0.9148
422	20J	0.9148
423	C1M	0.9147
424	SNU	0.9147
425	0BP	0.9147
426	LZM	0.9146
427	G12	0.9145
428	JBK	0.9144
429	VGD	0.9144
430	K34	0.9143
431	ISZ	0.9141
432	BE2	0.9141
433	1Y6	0.9141
434	DEE	0.9140
435	C2U	0.9138
436	42A	0.9137
437	HZQ	0.9137
438	6QF	0.9136
439	ESP	0.9136
440	HLZ	0.9135
441	9ZE	0.9134
442	M0W	0.9134
443	141	0.9133
444	OA3	0.9130
445	QWN	0.9130
446	XAN	0.9130
447	FYU	0.9129
448	CFI	0.9129
449	5VM	0.9128
450	IWT	0.9127
451	A2F	0.9127
452	6M9	0.9127
453	14O	0.9126
454	X0V	0.9126
455	5H1	0.9126
456	NPY	0.9126
457	BCU	0.9125
458	F60	0.9125
459	LDR	0.9124
460	5B1	0.9123
461	M0Q	0.9121
462	YH7	0.9121
463	ESX	0.9119
464	7WR	0.9119
465	G1O	0.9118
466	RMN	0.9118
467	K97	0.9116
468	0W1	0.9115
469	5WX	0.9114
470	V1T	0.9113
471	PFB	0.9113
472	4ZA	0.9111
473	9TZ	0.9110
474	6F0	0.9109
475	MO8	0.9107
476	BZJ	0.9107
477	EXD	0.9107
478	7B4	0.9107
479	PHU	0.9105
480	K32	0.9105
481	5NS	0.9105
482	ROI	0.9104
483	2H5	0.9104
484	6AP	0.9102
485	0FN	0.9102
486	KTJ	0.9101
487	HDH	0.9098
488	3J8	0.9098
489	AZG	0.9097
490	2AL	0.9097
491	DX4	0.9096
492	FBT	0.9096
493	5MI	0.9092
494	4XV	0.9092
495	2K4	0.9091
496	M3H	0.9090
497	F9Y	0.9089
498	6VD	0.9089
499	HBD	0.9087
500	BK9	0.9085
501	9AP	0.9084
502	QSH	0.9084
503	NAG	0.9084
504	DNC	0.9083
505	537	0.9081
506	1XA	0.9080
507	1WC	0.9080
508	BPU	0.9079
509	B5D	0.9079
510	3FH	0.9079
511	DRG	0.9078
512	JU2	0.9078
513	CWJ	0.9077
514	6AI	0.9077
515	8XL	0.9077
516	UFV	0.9074
517	4SV	0.9072
518	SRO	0.9072
519	8OZ	0.9072
520	BNL	0.9072
521	ZZZ	0.9071
522	P92	0.9071
523	3U4	0.9070
524	JND	0.9070
525	JBE	0.9069
526	JB8	0.9068
527	290	0.9068
528	PXM	0.9068
529	5MK	0.9067
530	BHO	0.9067
531	GJS	0.9066
532	5WU	0.9066
533	CK2	0.9065
534	KJY	0.9065
535	SVN	0.9065
536	LDP	0.9065
537	GZL	0.9064
538	ES6	0.9063
539	3MG	0.9063
540	M1E	0.9062
541	E7S	0.9062
542	M4E	0.9061
543	E5X	0.9061
544	4MA	0.9059
545	M1H	0.9059
546	2ZV	0.9058
547	K22	0.9057
548	5MB	0.9055
549	B53	0.9055
550	TPA	0.9054
551	5TY	0.9052
552	ASO	0.9050
553	DX3	0.9049
554	O72	0.9048
555	4FH	0.9048
556	GM7	0.9047
557	JA8	0.9046
558	F05	0.9046
559	1DW	0.9045
560	GNM	0.9043
561	PBA	0.9042
562	4XR	0.9042
563	6FZ	0.9041
564	APG	0.9041
565	HMH	0.9040
566	4SX	0.9039
567	AEZ	0.9039
568	1XM	0.9038
569	GF4	0.9037
570	QXW	0.9036
571	DPT	0.9034
572	1XN	0.9033
573	L99	0.9033
574	9EW	0.9031
575	PBZ	0.9030
576	EKZ	0.9028
577	6KT	0.9028
578	GYE	0.9026
579	IAC	0.9025
580	MR1	0.9025
581	7ME	0.9024
582	SOE	0.9024
583	2O6	0.9023
584	I1E	0.9023
585	68A	0.9023
586	DIU	0.9022
587	PD2	0.9021
588	3DM	0.9021
589	HTP	0.9021
590	X05	0.9020
591	DBX	0.9020
592	BOA	0.9019
593	BCP	0.9019
594	B56	0.9018
595	NVU	0.9018
596	UNJ	0.9017
597	2A9	0.9016
598	TSS	0.9015
599	0RW	0.9009
600	069	0.9009
601	G6D	0.9007
602	826	0.9006
603	I6G	0.9006
604	SX1	0.9005
605	11S	0.9001
606	BSP	0.9001
607	R20	0.9001
608	PZI	0.9001
609	2HC	0.9000
610	ADA	0.9000
611	12B	0.8999
612	J9N	0.8999
613	JKE	0.8999
614	4V2	0.8996
615	JF1	0.8996
616	4XS	0.8995
617	3AB	0.8995
618	PHE	0.8995
619	EJZ	0.8994
620	HH5	0.8992
621	KIB	0.8991
622	L22	0.8990
623	36E	0.8990
624	3HB	0.8989
625	HLR	0.8988
626	0CU	0.8988
627	LZ2	0.8988
628	DBJ	0.8988
629	ANC	0.8987
630	X11	0.8987
631	4AN	0.8987
632	J9T	0.8986
633	ORO	0.8985
634	PX7	0.8985
635	8GC	0.8984
636	F9P	0.8984
637	23J	0.8982
638	8MO	0.8982
639	4CS	0.8982
640	Z82	0.8981
641	MVL	0.8981
642	2CK	0.8980
643	JXN	0.8979
644	XXP	0.8979
645	F4E	0.8978
646	39A	0.8978
647	KGK	0.8975
648	THA	0.8975
649	ISE	0.8975
650	6GU	0.8973
651	K5W	0.8970
652	SW7	0.8970
653	GIM	0.8970
654	18N	0.8970
655	149	0.8968
656	Q02	0.8967
657	OXC	0.8965
658	ES9	0.8964
659	A5E	0.8963
660	7WV	0.8961
661	8H8	0.8960
662	7VP	0.8960
663	D07	0.8960
664	L7T	0.8960
665	FBM	0.8958
666	6M4	0.8957
667	M5H	0.8957
668	BZE	0.8957
669	0XT	0.8956
670	36Y	0.8956
671	K6X	0.8955
672	82I	0.8955
673	HA7	0.8955
674	EYK	0.8953
675	8G0	0.8952
676	HX4	0.8952
677	MOK	0.8951
678	10L	0.8950
679	R6T	0.8950
680	SWD	0.8949
681	1WD	0.8948
682	PNZ	0.8948
683	AP4	0.8947
684	GAB	0.8946
685	ADE	0.8945
686	5HN	0.8944
687	GHM	0.8944
688	717	0.8943
689	TYL	0.8941
690	174	0.8941
691	GLA	0.8941
692	53C	0.8941
693	PRZ	0.8939
694	LAO	0.8939
695	GCW	0.8939
696	3QV	0.8938
697	6MP	0.8938
698	7MU	0.8935
699	F1A	0.8934
700	3ZB	0.8933
701	K8X	0.8933
702	34D	0.8932
703	4HM	0.8932
704	BP1	0.8931
705	4BL	0.8931
706	M45	0.8931
707	KW8	0.8931
708	QAT	0.8929
709	7MX	0.8928
710	DOR	0.8926
711	FP1	0.8925
712	BEZ	0.8925
713	4BZ	0.8925
714	KOJ	0.8924
715	EUG	0.8921
716	GZ8	0.8921
717	23A	0.8920
718	JF2	0.8919
719	BPN	0.8919
720	HPA	0.8918
721	FK1	0.8918
722	J6W	0.8918
723	9UL	0.8917
724	LSA	0.8915
725	QIC	0.8915
726	G2F	0.8913
727	GCO	0.8913
728	JP2	0.8912
729	X0U	0.8911
730	ANN	0.8911
731	3GQ	0.8911
732	QAS	0.8910
733	IPB	0.8910
734	XQG	0.8910
735	YSO	0.8910
736	AC6	0.8909
737	4NB	0.8908
738	JR2	0.8907
739	GIO	0.8907
740	BEN	0.8906
741	6PC	0.8904
742	7WA	0.8903
743	BAM	0.8902
744	GIV	0.8900
745	H4N	0.8899
746	2FG	0.8898
747	AW5	0.8897
748	OVM	0.8897
749	61M	0.8897
750	NCA	0.8895
751	3MB	0.8894
752	3NT	0.8894
753	9PY	0.8891
754	GV9	0.8891
755	TIU	0.8889
756	1L5	0.8889
757	FBS	0.8889
758	2CL	0.8888
759	GOX	0.8887
760	FB1	0.8886
761	MT5	0.8883
762	RPQ	0.8883
763	PAC	0.8881
764	AHR	0.8881
765	4BY	0.8880
766	428	0.8879
767	CN0	0.8878
768	TSU	0.8877
769	FCR	0.8876
770	O2A	0.8875
771	FA3	0.8874
772	9DA	0.8873
773	692	0.8873
774	2D3	0.8872
775	9RH	0.8871
776	MPV	0.8871
777	JYB	0.8871
778	OVV	0.8870
779	505	0.8870
780	NMJ	0.8869
781	D1X	0.8869
782	60Q	0.8868
783	E1K	0.8868
784	LT8	0.8866
785	KBB	0.8863
786	54X	0.8862
787	SAN	0.8862
788	1Z6	0.8860
789	XQK	0.8860
790	64C	0.8858
791	MAN	0.8857
792	WCE	0.8856
793	7HP	0.8855
794	X09	0.8855
795	WOO	0.8855
796	MHK	0.8854
797	OMD	0.8854
798	A13	0.8853
799	HBO	0.8851
800	ES4	0.8850
801	HX3	0.8850
802	RHU	0.8850
803	NSP	0.8849
804	3OC	0.8849
805	GOG	0.8847
806	BTE	0.8847
807	PPY	0.8847
808	ZZ8	0.8846
809	KFH	0.8845
810	FHC	0.8845
811	3R4	0.8844
812	SYA	0.8844
813	C9E	0.8843
814	6R8	0.8842
815	AX3	0.8841
816	SRT	0.8840
817	1GN	0.8839
818	VOH	0.8838
819	P72	0.8837
820	49O	0.8837
821	PM6	0.8834
822	9HX	0.8833
823	EOL	0.8830
824	261	0.8830
825	FBV	0.8829
826	OTR	0.8829
827	LNR	0.8827
828	5LA	0.8825
829	MBG	0.8825
830	BNT	0.8824
831	NIO	0.8823
832	7I2	0.8821
833	UNU	0.8821
834	F6P	0.8821
835	XM5	0.8819
836	YCP	0.8818
837	RUY	0.8817
838	8NY	0.8816
839	1X7	0.8816
840	091	0.8816
841	MAJ	0.8816
842	YQA	0.8814
843	INS	0.8814
844	3R6	0.8813
845	GO2	0.8813
846	X0W	0.8810
847	HMU	0.8810
848	DQN	0.8810
849	NGO	0.8809
850	ADK	0.8808
851	EGR	0.8808
852	ASC	0.8807
853	LQ2	0.8807
854	F69	0.8807
855	DHY	0.8806
856	FAN	0.8805
857	DE5	0.8801
858	3BZ	0.8799
859	51R	0.8794
860	1QP	0.8792
861	9RW	0.8790
862	NBZ	0.8789
863	AC0	0.8789
864	KBG	0.8788
865	CKA	0.8786
866	K44	0.8786
867	VNJ	0.8784
868	N7I	0.8784
869	KTA	0.8784
870	45L	0.8780
871	IFL	0.8779
872	M6Z	0.8778
873	4J8	0.8777
874	A9P	0.8777
875	YIO	0.8776
876	FA1	0.8774
877	F2W	0.8774
878	4LW	0.8772
879	RAT	0.8771
880	SG2	0.8771
881	GAF	0.8771
882	GCV	0.8771
883	X6X	0.8771
884	HHI	0.8771
885	UEG	0.8770
886	BRT	0.8770
887	PQK	0.8770
888	S60	0.8768
889	HFB	0.8768
890	GXL	0.8768
891	1U6	0.8766
892	MZB	0.8766
893	OAA	0.8765
894	OW4	0.8763
895	GZ2	0.8763
896	OQC	0.8762
897	XXR	0.8762
898	3DO	0.8761
899	EMZ	0.8760
900	4NM	0.8757
901	IOS	0.8757
902	JRB	0.8756
903	4VS	0.8756
904	NTN	0.8755
905	BMA	0.8753
906	SKF	0.8753
907	KJ5	0.8753
908	1VK	0.8752
909	6FB	0.8751
910	VGL	0.8751
911	E35	0.8750
912	DGJ	0.8747
913	XX3	0.8743
914	TSR	0.8742
915	NOY	0.8742
916	AL0	0.8742
917	8GK	0.8738
918	ZME	0.8737
919	AIN	0.8735
920	4I8	0.8734
921	NDG	0.8734
922	KYD	0.8733
923	SMN	0.8730
924	KIF	0.8730
925	1WG	0.8729
926	DHR	0.8728
927	E3D	0.8727
928	293	0.8727
929	FUD	0.8726
930	XXG	0.8725
931	OGA	0.8725
932	7MK	0.8724
933	BGU	0.8721
934	PCI	0.8720
935	S0E	0.8719
936	PBC	0.8717
937	GLT	0.8716
938	EV0	0.8715
939	06B	0.8714
940	EVF	0.8714
941	XDE	0.8711
942	3RK	0.8711
943	2JK	0.8710
944	24B	0.8710
945	FBW	0.8708
946	BIK	0.8707
947	2MN	0.8707
948	H62	0.8705
949	K37	0.8704
950	PZA	0.8703
951	JKZ	0.8703
952	DC5	0.8701
953	FBU	0.8699
954	TQU	0.8699
955	2CQ	0.8699
956	HLD	0.8697
957	TH0	0.8697
958	4VY	0.8697
959	FF2	0.8696
960	NLA	0.8695
961	39U	0.8693
962	5VJ	0.8691
963	IND	0.8690
964	ALL	0.8689
965	DYA	0.8689
966	DEN	0.8689
967	DK1	0.8684
968	FK8	0.8684
969	QUS	0.8678
970	XFE	0.8678
971	N0Z	0.8677
972	DHS	0.8675
973	PHT	0.8675
974	AMG	0.8675
975	4NO	0.8675
976	259	0.8671
977	PO6	0.8670
978	AAS	0.8670
979	OK7	0.8669
980	H6B	0.8669
981	D3G	0.8667
982	363	0.8666
983	3BU	0.8666
984	1AL	0.8665
985	NTM	0.8664
986	K25	0.8662
987	FBG	0.8661
988	MT8	0.8661
989	LZ1	0.8660
990	F5B	0.8660
991	SNO	0.8660
992	3TJ	0.8660
993	SJ5	0.8659
994	8VE	0.8658
995	PA1	0.8657
996	BCF	0.8656
997	BZI	0.8656
998	1MC	0.8655
999	329	0.8654
1000	URF	0.8654
1001	P3K	0.8652
1002	BA5	0.8651
1003	3SK	0.8650
1004	MPI	0.8649
1005	ZZT	0.8649
1006	LYL	0.8648
1007	FH2	0.8648
1008	MPK	0.8647
1009	150	0.8647
1010	R2P	0.8643
1011	SN4	0.8643
1012	3XX	0.8642
1013	GSY	0.8642
1014	463	0.8641
1015	3Y7	0.8641
1016	FDK	0.8640
1017	0R1	0.8640
1018	P7Y	0.8640
1019	PYD	0.8640
1020	QQQ	0.8638
1021	HDL	0.8634
1022	BBF	0.8633
1023	AMS	0.8629
1024	X48	0.8629
1025	IBF	0.8629
1026	4HO	0.8629
1027	CXH	0.8626
1028	4ZE	0.8626
1029	DQA	0.8626
1030	2QC	0.8626
1031	MCT	0.8625
1032	3Z7	0.8623
1033	TDR	0.8622
1034	XBZ	0.8622
1035	6XI	0.8621
1036	HBA	0.8621
1037	S7J	0.8621
1038	QMP	0.8620
1039	0LH	0.8620
1040	5GT	0.8620
1041	S2P	0.8619
1042	WBU	0.8619
1043	2LP	0.8619
1044	43M	0.8619
1045	ZXD	0.8616
1046	275	0.8615
1047	F3B	0.8615
1048	BZF	0.8612
1049	0CT	0.8611
1050	WOT	0.8610
1051	DMJ	0.8610
1052	2MP	0.8609
1053	CXF	0.8609
1054	KLW	0.8608
1055	34A	0.8605
1056	6E8	0.8602
1057	4V6	0.8601
1058	IF7	0.8600
1059	YRL	0.8600
1060	H7Y	0.8600
1061	FA6	0.8600
1062	4ZC	0.8599
1063	HSO	0.8597
1064	MWM	0.8596
1065	5UC	0.8592
1066	HXX	0.8592
1067	JF6	0.8590
1068	3MA	0.8590
1069	R8S	0.8589
1070	GVH	0.8588
1071	FBF	0.8587
1072	FQX	0.8586
1073	2YU	0.8586
1074	XYD	0.8585
1075	2AC	0.8584
1076	F4K	0.8584
1077	6X9	0.8583
1078	PKU	0.8582
1079	RNO	0.8579
1080	P9E	0.8579
1081	JFD	0.8578
1082	JIF	0.8578
1083	TAG	0.8578
1084	IDM	0.8576
1085	3AL	0.8570
1086	AEF	0.8570
1087	2CZ	0.8569
1088	ICP	0.8567
1089	MJ2	0.8565
1090	AMH	0.8565
1091	OXQ	0.8565
1092	G4D	0.8564
1093	DS0	0.8562
1094	EXO	0.8560
1095	M1Z	0.8560
1096	ZWZ	0.8560
1097	GOJ	0.8557
1098	0R0	0.8555
1099	XCZ	0.8552
1100	DIE	0.8549
1101	BIO	0.8548
1102	JZ3	0.8542
1103	0OC	0.8540
1104	45C	0.8540
1105	LMR	0.8538
1106	OVP	0.8535
1107	JZ2	0.8534
1108	M4S	0.8531
1109	QSC	0.8530
1110	2PG	0.8530
1111	ITE	0.8530
1112	IUR	0.8514

Similar Binding Sites (Proteins are less than 50% similar to leader)

Pocket No.: 1; Query (leader) PDB : 4UYE; Ligand: 9F9; Similar sites found with APoc: 4

This union binding pocket(no: 1) in the query (biounit: 4uye.bio1) has 19 residues
No:	Leader PDB	Ligand	Sequence Similarity
1	4YC9	4C1	35.5932
2	6J3O	B4L	38.1356
3	5MLJ	9ST	40.1786
4	5ML0	P2L	45.4545

Pocket No.: 2; Query (leader) PDB : 4UYE; Ligand: 9F9; Similar sites found with APoc: 7

This union binding pocket(no: 2) in the query (biounit: 4uye.bio2) has 16 residues
No:	Leader PDB	Ligand	Sequence Similarity
1	6J3P	B8O	38.1356
2	6J3O	B4L	38.1356
3	6J3P	B8O	38.1356
4	5TPX	7H7	38.9831
5	5MLJ	9ST	40.1786
6	5MLJ	9ST	40.1786
7	5ML0	P2L	45.4545

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