Receptor
PDB id Resolution Class Description Source Keywords
2g5u 1.8 Å NON-ENZYME: TRANSPORT HUMAN TRANSTHYRETIN (TTR) COMPLEXED WITH HYDROXYLATED POLYCH BIPHENYL-4,4'-DIHYDROXY-3,3',5,5'-TETRACHLOROBIPHENYL HOMO SAPIENS TTR AMYLOID TRANSTHYRETIN HORMONE-GROWTH FACTOR COMPLEX
Ref.: HYDROXYLATED POLYCHLORINATED BIPHENYLS SELECTIVELY TRANSTHYRETIN IN BLOOD AND INHIBIT AMYLOIDOGENESIS: RATIONALIZING RODENT PCB TOXICITY CHEM.BIOL. V. 11 1719 2004
Ligand
Ligand Chain:Residue Validity Ligand Warnings Binding Data Chemaxon Viewer Molecular Weight (Da) Formula SMILES
PCQ A:240;
B:239;
Valid;
Valid;
none;
none;
Kd = 3.2 nM 323.987 C12 H6 Cl4 O2 c1c(c...
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90% Homology Family
Leader
PDB id Resolution Class Description Source Keywords
3TCT 1.3 Å NON-ENZYME: TRANSPORT STRUCTURE OF WILD-TYPE TTR IN COMPLEX WITH TAFAMIDIS HOMO SAPIENS AMYLOID AMYLOIDOSIS DISEASE MUTATION GAMMA-CARBOXYGLUTAMIGLYCOPROTEIN HORMONE NEUROPATHY SECRETED THYROID HORMONTRANSPORT KINETIC STABILIZER INHIBITION OF THE AMYLOID CABINDING PROTEIN
Ref.: TAFAMIDIS, A POTENT AND SELECTIVE TRANSTHYRETIN KIN STABILIZER THAT INHIBITS THE AMYLOID CASCADE. PROC.NATL.ACAD.SCI.USA V. 109 9629 2012
Members (94)
No: PDB id Binding Data Representative ligand Formula Smiles
The Class containing this family consists of a total of 170 families.
1 1TLM - MIL C12 H9 N3 O CC1=C(C=C(....
2 2QGD - MR5 C13 H7 Br2 N O2 c1ccc2c(c1....
3 2B16 - DNF C6 H4 N2 O5 c1cc(c(cc1....
4 4ABV ic50 = 0.85 uM FT2 C13 H9 Cl3 O2 c1cc(c(cc1....
5 3ESO - DZ2 C13 H7 Br2 Cl2 N O2 c1cc(c(cc1....
6 3GLZ - 1BD C11 H10 F3 N O3 c1ccc(c(c1....
7 2G9K - NE1 C12 H5 Cl5 O c1cc(c(c(c....
8 4HJU - 16L C19 H19 N O2 Cc1cc(cc(c....
9 2FLM - 6CA C32 H31 N O6 c1ccc(c(c1....
10 3IMU - IW4 C14 H12 Br2 N2 c1cc(cc(c1....
11 4ABU ic50 = 0.52 uM FT1 C13 H8 Cl2 O3 c1cc(c(cc1....
12 2G5U Kd = 3.2 nM PCQ C12 H6 Cl4 O2 c1c(cc(c(c....
13 3NEX - G24 C24 H24 O4 Cc1cc(cc(c....
14 4DER ic50 = 10.3 uM AGI C15 H10 O5 c1cc(ccc1C....
15 3CN3 - LJ4 C12 H8 Br2 O2 c1ccc(cc1)....
16 3GS4 - 7BD C16 H13 N O3 c1ccc2c(c1....
17 3IPB ic50 = 0.2 uM JZD C37 H38 Cl4 N2 O6 c1ccc(c(c1....
18 1THA - T33 C15 H13 I2 N O4 c1cc(c(cc1....
19 1F86 - T44 C15 H11 I4 N O4 Ic1c(Oc2cc....
20 1TYR Kd = 0.1 uM REA C20 H28 O2 CC1=C(C(CC....
21 1DVY - BPD C21 H12 F3 N O5 c1cc(cc(c1....
22 4AC2 - 43F C14 H11 Cl3 O2 COc1cc(ccc....
23 3NEE - B72 C20 H24 O4 Cc1cc(cc(c....
24 3GS7 - 8BD C11 H13 N O4 COc1ccccc1....
25 4DEU ic50 = 12.39 uM NAR C15 H12 O5 c1cc(ccc1[....
26 4HIQ Kd = 193 nM 16V C15 H17 F N2 O3 Cc1c(c(n[n....
27 3IMR - IW1 C14 H8 Br2 Cl2 O c1cc(c(c(c....
28 3KGU Kd = 1.2 uM GEN C15 H10 O5 c1cc(ccc1C....
29 4HJT - 18A C19 H21 N O2 CCC(=O)Nc1....
30 3ESP - DZ3 C15 H13 Br2 N O3 Cc1cc(cc(c....
31 1BM7 Kd = 30 nM FLF C14 H10 F3 N O2 c1ccc(c(c1....
32 1DVU - DBF C14 H8 O5 c1cc2c3ccc....
33 3TCT Kd = 2 nM 3MI C14 H7 Cl2 N O3 c1cc2c(cc1....
34 2FBR - 44C C30 H27 N O6 c1ccc(c(c1....
35 1U21 Kd = 5 nM P2C C13 H9 Cl2 N O5 c1ccc(c(c1....
36 2QGC - MR4 C15 H13 N O2 Cc1cc(cc(c....
37 2B77 - 3CA C13 H8 Cl2 O3 c1cc(c(cc1....
38 2F7I - 26C C13 H8 F2 O2 c1cc(c(c(c....
39 1E4H Kd = 3.9 nM PBR C6 H Br5 O c1(c(c(c(c....
40 4HIS Kd = 247 nM 3MI C14 H7 Cl2 N O3 c1cc2c(cc1....
41 3CN4 - LJ5 C13 H9 Br2 N O2 c1ccc(cc1)....
42 3IMV - IW5 C14 H12 Br2 N2 c1cc(ccc1/....
43 2GAB - NE2 C12 H6 Cl4 O c1cc(c(cc1....
44 3CN0 - LJ1 C16 H16 O Cc1cc(cc(c....
45 3GS0 - 6BD C17 H15 N O3 C[C@@H](CO....
46 1DVX - DIF C14 H11 Cl2 N O2 c1ccc(c(c1....
47 4FI6 - 0U7 C14 H7 Cl2 F N2 O3 S c1cc(cc(c1....
48 3M1O - CJZ C13 H9 Cl2 N O3 c1ccc(c(c1....
49 1DVT - FLP C15 H13 F O2 Fc1c(-c2cc....
50 3FCB ic50 = 4.9 uM IFB C16 H12 F2 I N O4 c1cc(c(cc1....
51 2ROX - T44 C15 H11 I4 N O4 Ic1c(Oc2cc....
52 3IMS - IW2 C14 H10 Br2 Cl2 O c1cc(c(c(c....
53 4DET ic50 = 8.26 uM KMP C15 H10 O6 O=C1C(O)=C....
54 4HJS Ki = 1.2 uM 18J C18 H21 N O3 S CCS(=O)(=O....
55 3FC8 ic50 = 4.1 uM IFA C17 H14 F2 I N O4 COC(=O)CCN....
56 4I85 - H50 C16 H11 Cl2 F O2 c1cc(c(cc1....
57 3D2T Kd = 1100 nM 1FL C13 H8 F2 O3 c1cc(c(cc1....
58 1E5A Kd = 23 nM TBP C6 H3 Br3 O c1c(cc(c(c....
59 3KGT Kd = 3.1 uM GEN C15 H10 O5 c1cc(ccc1C....
60 3CFT Kd = 64 uM 5NS C10 H9 N O3 S c1cc2c(ccc....
61 1ETA - T44 C15 H11 I4 N O4 Ic1c(Oc2cc....
62 3IMW - IW6 C16 H15 Br2 N O2 COc1cccc(c....
63 1THC - FL9 C15 H8 Br2 O6 c1c(cc2c(c....
64 4FI7 - 0UA C14 H7 Cl2 F N2 O4 S c1cc(cc(c1....
65 2QGE - MR6 C15 H13 N O Cc1cc(cc(c....
66 3IPE ic50 = 0.15 uM JZE C33 H30 Cl4 N2 O6 c1ccc(c(c1....
67 1TZ8 - DES C18 H20 O2 CC/C(=C(/C....
68 4ABW - 42M C14 H14 N2 O7 COc1cc(ccc....
69 1Z7J - T4A C14 H8 I4 O4 c1c(cc(c(c....
70 4I89 - 1FL C13 H8 F2 O3 c1cc(c(cc1....
71 2B15 - DNF C6 H4 N2 O5 c1cc(c(cc1....
72 3CN1 - LJ2 C14 H10 Br2 O c1ccc(cc1)....
73 2F8I - 205 C14 H7 Cl2 N O3 c1cc(c(c(c....
74 1DVZ Kd = 78 nM OFL C14 H10 F3 N O2 c1ccc(c(c1....
75 2B9A - FBC C13 H8 F2 O2 c1cc(ccc1c....
76 3CFQ - DIF C14 H11 Cl2 N O2 c1ccc(c(c1....
77 1DVS - STL C14 H12 O3 c1cc(ccc1C....
78 3NEO - G24 C24 H24 O4 Cc1cc(cc(c....
79 3IMT - IW3 C14 H11 Br2 N O c1cc(ccc1/....
80 2ROY - P28 C17 H15 N3 O9 CC(=O)N[C@....
81 1TT6 - DES C18 H20 O2 CC/C(=C(/C....
82 3ESN - DZ1 C15 H13 Br2 N O2 Cc1cccc(c1....
83 3B56 - DIU C7 H4 I2 O3 c1c(cc(c(c....
84 3NG5 - KDH C22 H18 O11 c1c(cc(c(c....
85 1Y1D - FHI C13 H7 F2 I O3 c1cc(c(cc1....
86 3CN2 - LJ3 C12 H8 Br2 O c1ccc(cc1)....
87 4DES ic50 = 12.16 uM 57D C15 H10 O4 c1ccc(cc1)....
88 4I87 - H50 C16 H11 Cl2 F O2 c1cc(c(cc1....
89 4FI8 - 0UC C14 H6 Br Cl2 F N2 O4 S c1cc(c(cc1....
90 1ETB - T44 C15 H11 I4 N O4 Ic1c(Oc2cc....
91 2B14 - DNF C6 H4 N2 O5 c1cc(c(cc1....
92 4ABQ - 4V2 C8 H6 N2 O2 S c1cc(cc(c1....
93 3NES - B72 C20 H24 O4 Cc1cc(cc(c....
94 3CFN Kd = 4.3 uM 2AN C16 H13 N O3 S c1ccc(cc1)....