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Q96RJ0 | TAAR1_HUMAN | Trace amine-associated receptor 1 (TAAR1)

3D structures mapped by conservation among orthologs



[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL2206400 OBDepict H N N Ki = 2.0 nM 172.23 c1ccc(CCc2c[nH]cn2)cc1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206385 OBDepict CH 3 N N Cl N H Ki = 2.0 nM 235.72 CCN(Cc1cnc[nH]1)c1cccc(Cl)c1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206376 OBDepict H 3 C N CH 3 N Cl N H Cl Ki = 4.0 nM 284.19 CC(C)N(Cc1cnc[nH]1)c1ccc(Cl)c(Cl)c1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206377 OBDepict Cl Cl N H 3 C CH 3 N N H Ki = 4.0 nM 284.19 CC(C)N(Cc1cnc[nH]1)c1cc(Cl)cc(Cl)c1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206890 OBDepict Cl N CH 3 H 3 C N N H Ki = 4.0 nM 249.75 CC(C)N(Cc1cnc[nH]1)c1cccc(Cl)c1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206381 OBDepict CH 3 O N CH 3 H 3 C N N H Ki = 5.0 nM 245.33 COc1cccc(N(Cc2cnc[nH]2)C(C)C)c1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206375 OBDepict H 3 C N CH 3 N N H Cl Ki = 6.0 nM 249.75 CC(C)N(Cc1cnc[nH]1)c1ccc(Cl)cc1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206384 OBDepict Cl N CH 3 N N H Ki = 11.0 nM 221.69 CN(Cc1cnc[nH]1)c1cccc(Cl)c1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206402 OBDepict CH 3 N N N H Ki = 11.0 nM 187.25 CN(Cc1cnc[nH]1)c1ccccc1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206388 OBDepict CH 3 O N N CH 3 H 3 C N N H Ki = 12.0 nM 246.31 COc1cccc(N(Cc2cnc[nH]2)C(C)C)n1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206408 OBDepict H N N N Ki = 12.0 nM 213.28 c1ccc2c(c1)CCCN2Cc1c[nH]cn1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206379 OBDepict F N H 3 C CH 3 N N H Ki = 12.0 nM 233.29 CC(C)N(Cc1c[nH]cn1)c1cccc(F)c1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206380 OBDepict H 3 C N CH 3 N N H F Ki = 13.0 nM 233.29 CC(C)N(Cc1cnc[nH]1)c1ccc(F)cc1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206378 OBDepict H N N N H 3 C CH 3 F Ki = 18.0 nM 233.29 CC(C)N(Cc1c[nH]cn1)c1ccccc1F Homo sapiens CHEMBL2213071 cell-based format
CHEMBL494421 OBDepict H N N Ki = 20.0 nM 158.2 c1ccc(Cc2c[nH]cn2)cc1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206404 OBDepict H 3 C N CH 3 N N H Ki = 22.0 nM 215.3 CC(C)N(Cc1cnc[nH]1)c1ccccc1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206397 OBDepict CH 3 N N CH 3 H Ki = 24.0 nM 214.31 CCc1cccc(CC)c1Cc1ncc[nH]1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL348369 OBDepict H N N N Ki = 32.0 nM 263.34 c1ccc(CN(Cc2c[nH]cn2)c2ccccc2)cc1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206386 OBDepict Cl N H 3 C H 3 C CH 3 N N H Ki = 33.0 nM 263.77 CC(C)(C)N(Cc1c[nH]cn1)c1cccc(Cl)c1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206407 OBDepict H N N N Ki = 35.0 nM 199.26 c1ccc2c(c1)CCN2Cc1c[nH]cn1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206396 OBDepict CH 3 CH 3 N N H Ki = 36.0 nM 186.26 Cc1cccc(C)c1Cc1ncc[nH]1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206889 OBDepict H N N N H 3 C CH 3 Cl Ki = 40.0 nM 249.75 CC(C)N(Cc1c[nH]cn1)c1ccccc1Cl Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206403 OBDepict CH 3 N N N H Ki = 48.0 nM 201.27 CCN(Cc1cnc[nH]1)c1ccccc1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206401 OBDepict H N N N H Ki = 65.0 nM 173.22 c1ccc(NCc2c[nH]cn2)cc1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206371 OBDepict Cl N CH 3 H 3 C N N H Ki = 68.0 nM 249.75 CC(C)N(Cc1ncc[nH]1)c1cccc(Cl)c1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206405 OBDepict H N N N Ki = 69.0 nM 249.32 c1ccc(N(Cc2c[nH]cn2)c2ccccc2)cc1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206382 OBDepict CH 3 O N CH 3 H 3 C N N H Ki = 80.0 nM 245.33 COc1ccc(N(Cc2c[nH]cn2)C(C)C)cc1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL71033 OBDepict CH 3 CH 3 N H N Ki = 82.0 nM 188.27 Cc1cccc(C)c1CC1=NCCN1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206390 OBDepict CH 3 N N N N O N CH 3 H Ki = 84.0 nM 233.28 CCN(Cc1c[nH]cn1)c1nccc(OC)n1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206406 OBDepict H N N N Ki = 100.0 nM 213.28 c1ccc(N(Cc2c[nH]cn2)C2CC2)cc1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206389 OBDepict H N N N N N H 3 C CH 3 Cl Ki = 100.0 nM 251.72 CC(C)N(Cc1c[nH]cn1)c1nccc(Cl)n1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206383 OBDepict H N N N CH 3 CH 3 S O O CH 3 Ki = 128.0 nM 293.39 CC(C)N(Cc1c[nH]cn1)c1cccc(S(C)(=O)=O)c1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206369 OBDepict Cl N H 3 C CH 3 N N H Ki = 138.0 nM 249.75 CC(C)N(Cc1ncc[nH]1)c1ccc(Cl)cc1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206387 OBDepict H N N N N H 3 C CH 3 Ki = 195.0 nM 216.29 CC(C)N(Cc1c[nH]cn1)c1ccccn1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206391 OBDepict CH 3 N H N CH 3 Ki = 300.0 nM 216.33 CCc1cccc(CC)c1CC1=NCCN1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206394 OBDepict H N N Ki = 400.0 nM 158.2 c1ccc(Cc2ncc[nH]2)cc1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206370 OBDepict H 3 C N CH 3 N N H Ki = 470.0 nM 215.3 CC(C)N(Cc1ncc[nH]1)c1ccccc1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL149652 OBDepict Cl Cl N H N Ki = 500.0 nM 229.11 Clc1cccc(Cl)c1CC1=NCCN1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206398 OBDepict CH 3 CH 3 N N CH 3 H 3 C H Ki = 630.0 nM 242.37 CC(C)c1cccc(C(C)C)c1Cc1ncc[nH]1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206372 OBDepict CH 3 N N N H Ki = 710.0 nM 201.27 CCN(Cc1ncc[nH]1)c1ccccc1 Homo sapiens CHEMBL2213071 cell-based format
CHEMBL2206392 OBDepict H 3 C CH 3 NH N H 3 C CH 3 Ki = 825.0 nM 244.38 CC(C)c1cccc(C(C)C)c1CC1=NCCN1 Homo sapiens CHEMBL2213071 cell-based format