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P18089 | ADA2B_HUMAN | Alpha-2B adrenergic receptor (ADRA2B)

3D structures mapped by conservation among orthologs



[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL157138 OBDepict H 3 C N N H O H 3 C H N CH 3 H N H Ki = 0.237 nM 338.46 CCN(CC)C(=O)N[C@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL157138 OBDepict H 3 C N N H O H 3 C H N CH 3 H N H IC50 = 0.518 nM 338.46 CCN(CC)C(=O)N[C@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL1909072 OBDepict Cl N S N O NH 2 Ki = 0.786 nM 401.96 NC(=O)C1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc32)CC1 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL1385840 OBDepict H N H N CH 3 H NH O O H 3 C CH 3 O N HO H N H CH 3 H 3 C O Ki = 1.396 nM 561.68 CC(C)[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]cc(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL1909072 OBDepict Cl N S N O NH 2 IC50 = 1.722 nM 401.96 NC(=O)C1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc32)CC1 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL442 OBDepict H N H N CH 3 H HN O CH 3 O O N OH H N H O Ki = 1.755 nM 581.67 CN1C[C@H](C(=O)N[C@]2(C)O[C@@]3(O)[C@@H]4CCCN4C(=O)[C@H](Cc4ccccc4)N3C2=O)C=C2c3cccc4[nH]cc(c34)C[C@H]21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL1732 OBDepict H N H N H CH 3 H HN O CH 3 O O N OH H N H O Ki = 1.766 nM 583.69 CN1C[C@H](C(=O)N[C@]2(C)O[C@@]3(O)[C@@H]4CCCN4C(=O)[C@H](Cc4ccccc4)N3C2=O)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL90943 OBDepict N N O N O Ki = 2.0 nM 389.5 C(=C/c1ccccc1)CN1CCN(CC2ON=C3c4ccccc4OCC32)CC1 Homo sapiens CHEMBL644760 single protein format
CHEMBL15245 OBDepict H 3 C O O H H OH H H H N N H Ki = 2.01 nM 354.45 COC(=O)[C@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@@H]21 Homo sapiens CHEMBL646117 cell-based format
CHEMBL1385840 OBDepict H N H N CH 3 H NH O O H 3 C CH 3 O N HO H N H CH 3 H 3 C O IC50 = 3.058 nM 561.68 CC(C)[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]cc(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL25467 OBDepict H 2 C S N CH 3 Cl Ki = 3.4 nM 263.79 C=Cc1sc2ccc(Cl)c3c2c1CN(C)CC3 Homo sapiens CHEMBL644759 cell-based format
CHEMBL629 OBDepict CH 3 N CH 3 Ki = 3.687 nM 277.41 CN(C)CCC=C1c2ccccc2CCc2ccccc21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL442 OBDepict H N H N CH 3 H HN O CH 3 O O N OH H N H O IC50 = 3.844 nM 581.67 CN1C[C@H](C(=O)N[C@]2(C)O[C@@]3(O)[C@@H]4CCCN4C(=O)[C@H](Cc4ccccc4)N3C2=O)C=C2c3cccc4[nH]cc(c34)C[C@H]21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL1732 OBDepict H N H N H CH 3 H HN O CH 3 O O N OH H N H O IC50 = 3.867 nM 583.69 CN1C[C@H](C(=O)N[C@]2(C)O[C@@]3(O)[C@@H]4CCCN4C(=O)[C@H](Cc4ccccc4)N3C2=O)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL10347 OBDepict H 3 C O O H H OH H H H N N H Ki = 4.7 nM 354.45 COC(=O)[C@@H]1[C@@H](O)CC[C@@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@@H]21 Homo sapiens CHEMBL644759 cell-based format
CHEMBL728 OBDepict CH 3 N N N S Cl Ki = 4.741 nM 373.95 CN1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc32)CC1 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL1627 OBDepict CH 3 NH O N HO Cl Ki = 7.0 nM 463.02 CNC(=O)C(CCN1CCC(O)(c2ccc(Cl)cc2)CC1)(c1ccccc1)c1ccccc1 Homo sapiens CHEMBL1025632 single protein format
CHEMBL362954 OBDepict CH 3 O N N H N H N CH 3 Ki = 7.3 nM 296.37 COc1cccc(N(NC2=NCCN2)c2ccc(C)cc2)c1 Homo sapiens CHEMBL884797 cell-based format
CHEMBL93171 OBDepict H 3 C O O CH 3 O N O N N H 3 C Ki = 7.5 nM 463.58 COc1cc2c(cc1OC)C1=NOC(CN3CCN(C/C(C)=C/c4ccccc4)CC3)C1CO2 Homo sapiens CHEMBL644760 single protein format
CHEMBL19215 OBDepict O O N H H N CH 3 H H N CH 3 Ki = 7.516 nM 403.53 CN1C[C@H](CNC(=O)OCc2ccccc2)C[C@@H]2c3cccc4c3c(cn4C)C[C@H]21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL597 OBDepict CH 3 N N H N HO Ki = 7.6 nM 281.36 Cc1ccc(N(CC2=NCCN2)c2cccc(O)c2)cc1 Homo sapiens CHEMBL644764 single protein format
CHEMBL478026 OBDepict O N H N O N N O O Ki = 8.0 nM 474.56 O=C(NCCN1CCN(CC2COc3ccccc3O2)CC1)c1cccnc1Oc1ccccc1 Homo sapiens CHEMBL983548 cell-based format
CHEMBL629 OBDepict CH 3 N CH 3 IC50 = 8.076 nM 277.41 CN(C)CCC=C1c2ccccc2CCc2ccccc21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL564 OBDepict CH 3 N CH 3 N S Ki = 8.418 nM 284.43 CN(C)CCCN1c2ccccc2Sc2ccccc21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL217299 OBDepict OH OH O N H Ki = 10.0 nM 269.3 Oc1cc2c(cc1O)C1c3ccccc3CNC1CO2 Homo sapiens CHEMBL912421 single protein format
CHEMBL728 OBDepict CH 3 N N N S Cl IC50 = 10.0 nM 373.95 CN1CCN(CCCN2c3ccccc3Sc3ccc(Cl)cc32)CC1 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL514837 OBDepict CH 3 O N N H O N N O O Ki = 10.5 nM 468.6 CCCCOc1ncccc1C(=O)NCCN1CCCN(CC2COc3ccccc3O2)CC1 Homo sapiens CHEMBL983548 cell-based format
CHEMBL476569 OBDepict CH 3 O N N H O N N O O Ki = 10.9 nM 468.6 CCCCOc1cccc(C(=O)NCCN2CCCN(CC3COc4ccccc4O3)CC2)n1 Homo sapiens CHEMBL983548 cell-based format
CHEMBL42 OBDepict H 3 C N N N NH Cl Ki = 11.0 nM 326.83 CN1CCN(C2=Nc3cc(Cl)ccc3Nc3ccccc32)CC1 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL268258 OBDepict CH 3 O H N H 3 C O Ki = 11.0 nM 349.47 COc1cccc2c1CCC[C@H]2CN(C)CCc1ccc2ccoc2c1 Homo sapiens CHEMBL644760 single protein format
CHEMBL1403281 OBDepict H 3 C CH 3 H N O N O HO O NH H H 3 C CH 3 O H N CH 3 H N H Ki = 12.0 nM 575.71 CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]cc(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL390718 OBDepict H 3 C O O CH 3 N H N O N N H 3 C Ki = 12.0 nM 462.59 COc1cc2c(cc1OC)C1=NOC(CN3CCN(C/C(C)=C/c4ccccc4)CC3)C1CN2 Homo sapiens CHEMBL905523 cell-based format
CHEMBL71 OBDepict CH 3 N CH 3 N S Cl Ki = 12.0 nM 318.87 CN(C)CCCN1c2ccccc2Sc2ccc(Cl)cc21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL85 OBDepict F O N N CH 3 N O N Ki = 12.0 nM 410.49 Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL422597 OBDepict H 3 C O O N O N N Ki = 12.0 nM 419.53 COc1ccc2c(c1)C1=NOC(CN3CCN(C/C=C/c4ccccc4)CC3)C1CO2 Homo sapiens CHEMBL644760 single protein format
CHEMBL726 OBDepict OH N N N S F F F Ki = 13.0 nM 437.53 OCCN1CCN(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL123138 OBDepict H 3 C N Br O Cl Ki = 14.0 nM 300.58 CN1CCc2c(Cl)ccc3oc(Br)c(c23)C1 Homo sapiens CHEMBL644759 cell-based format
CHEMBL328114 OBDepict H 3 C O O CH 3 O N O H H N N Ki = 14.0 nM 449.55 COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C=C/c4ccccc4)CC3)[C@@H]1CO2 Homo sapiens CHEMBL644760 single protein format
CHEMBL524153 OBDepict O N H N O N N H O O Ki = 14.3 nM 488.59 O=C(NCCN1CCCN(C[C@H]2COc3ccccc3O2)CC1)c1cccnc1Oc1ccccc1 Homo sapiens CHEMBL983548 cell-based format
CHEMBL123325 OBDepict H 3 C O O O H H H CH 3 H N N H Ki = 14.5 nM 352.43 COC(=O)C1=CO[C@@H](C)[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@H]12 Homo sapiens CHEMBL644759 cell-based format
CHEMBL537669 OBDepict H 3 C O O H H OH H H H N N H ClH Ki = 15.0 nM 390.91 COC(=O)[C@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@@H]21.Cl Homo sapiens CHEMBL903399 cell-based format
CHEMBL91157 OBDepict H 3 C O O CH 3 O N O H H N N H 3 C Ki = 15.0 nM 463.58 COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C(C)=C/c4ccccc4)CC3)[C@@H]1CO2 Homo sapiens CHEMBL644760 single protein format
CHEMBL123448 OBDepict H 3 C S N CH 3 Cl Ki = 15.0 nM 265.81 CCc1sc2ccc(Cl)c3c2c1CN(C)CC3 Homo sapiens CHEMBL644759 cell-based format
CHEMBL491420 OBDepict O N N N O N N O O Ki = 15.3 nM 499.57 c1ccc(Oc2ncccc2-c2noc(CN3CCCN(CC4COc5ccccc5O4)CC3)n2)cc1 Homo sapiens CHEMBL983548 cell-based format
CHEMBL123349 OBDepict CH 3 N Cl Ki = 16.0 nM 195.69 CN1CCc2cccc(Cl)c2CC1 Homo sapiens CHEMBL644759 cell-based format
CHEMBL90247 OBDepict CH 3 O O N O N N Ki = 16.0 nM 419.53 COc1ccc2c(c1)OCC1C2=NOC1CN1CCN(C/C=C/c2ccccc2)CC1 Homo sapiens CHEMBL644760 single protein format
CHEMBL19215 OBDepict O O N H H N CH 3 H H N CH 3 IC50 = 16.0 nM 403.53 CN1C[C@H](CNC(=O)OCc2ccccc2)C[C@@H]2c3cccc4c3c(cn4C)C[C@H]21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL516 OBDepict CH 3 N Ki = 17.0 nM 287.41 CN1CCC(=C2c3ccccc3C=Cc3ccccc32)CC1 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL15245 OBDepict H 3 C O O H H OH H H H N N H IC50 = 17.0 nM 354.45 COC(=O)[C@H]1[C@@H](O)CC[C@H]2CN3CCc4c([nH]c5ccccc45)[C@@H]3C[C@@H]21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL476774 OBDepict O N H N N N O O Ki = 17.9 nM 396.49 O=C(NCCN1CCCN(CC2COc3ccccc3O2)CC1)c1cccnc1 Homo sapiens CHEMBL983548 cell-based format
CHEMBL597 OBDepict CH 3 N N H N HO IC50 = 18.0 nM 281.36 Cc1ccc(N(CC2=NCCN2)c2cccc(O)c2)cc1 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL194849 OBDepict CH 3 N N H N H N HO Ki = 18.0 nM 282.35 Cc1ccc(N(NC2=NCCN2)c2cccc(O)c2)cc1 Homo sapiens CHEMBL884797 cell-based format
CHEMBL564 OBDepict CH 3 N CH 3 N S IC50 = 18.0 nM 284.43 CN(C)CCCN1c2ccccc2Sc2ccccc21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL318235 OBDepict H 3 C O O CH 3 O N O H H N N H 3 C F Ki = 21.0 nM 481.57 COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(C/C(C)=C/c4ccc(F)cc4)CC3)[C@@H]1CO2 Homo sapiens CHEMBL905523 cell-based format
CHEMBL42 OBDepict H 3 C N N N NH Cl IC50 = 23.0 nM 326.83 CN1CCN(C2=Nc3cc(Cl)ccc3Nc3ccccc32)CC1 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL90997 OBDepict F NH N Ki = 23.0 nM 218.28 Fc1ccc2c(c1)CC(CC1CN=CN1)C2 Homo sapiens CHEMBL644760 single protein format
CHEMBL643 OBDepict H 3 C N CH 3 CH 3 N S Ki = 24.0 nM 284.43 CC(CN1c2ccccc2Sc2ccccc21)N(C)C Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL6437 OBDepict CH 3 N N Ki = 24.0 nM 264.37 CN1CCN2c3ccccc3Cc3ccccc3C2C1 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL71 OBDepict CH 3 N CH 3 N S Cl IC50 = 26.0 nM 318.87 CN(C)CCCN1c2ccccc2Sc2ccc(Cl)cc21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL85 OBDepict F O N N CH 3 N O N IC50 = 26.0 nM 410.49 Cc1nc2n(c(=O)c1CCN1CCC(c3noc4cc(F)ccc34)CC1)CCCC2 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL1403281 OBDepict H 3 C CH 3 H N O N O HO O NH H H 3 C CH 3 O H N CH 3 H N H IC50 = 26.0 nM 575.71 CC(C)C[C@H]1C(=O)N2CCC[C@H]2[C@]2(O)O[C@](NC(=O)[C@@H]3C=C4c5cccc6[nH]cc(c56)C[C@H]4N(C)C3)(C(C)C)C(=O)N12 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL25554 OBDepict H 3 C O O O CH 3 N H O O Ki = 28.0 nM 345.4 COc1cccc(OC)c1OCCNCC1COc2ccccc2O1 Homo sapiens CHEMBL644764 single protein format
CHEMBL477608 OBDepict O N H N N H N H 3 C CH 3 H 3 C N O O Ki = 28.0 nM 467.61 CC(C)(C)Nc1ncccc1C(=O)NCCN1CCCN(CC2COc3ccccc3O2)CC1 Homo sapiens CHEMBL983548 cell-based format
CHEMBL726 OBDepict OH N N N S F F F IC50 = 29.0 nM 437.53 OCCN1CCN(CCCN2c3ccccc3Sc3ccc(C(F)(F)F)cc32)CC1 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL3735756 OBDepict CH 3 O O CH 3 N O O Ki = 29.0 nM 447.58 COc1ccc(CCN(CCCc2ccccc2)CCc2ccc3c(c2)OCO3)cc1OC Homo sapiens CHEMBL3736690 cell-based format
CHEMBL531 OBDepict CH 3 S H N H H CH 3 N H Ki = 29.0 nM 314.5 CCCN1C[C@H](CSC)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL1201203 OBDepict H O H N H CH 3 Ki = 30.0 nM 307.44 CN1[C@H]2CC[C@@H]1C[C@H](OC(c1ccccc1)c1ccccc1)C2 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL327875 OBDepict CH 3 O O H 3 C O N O N N CH 3 Ki = 31.0 nM 463.58 COc1cc2c(cc1OC)C1=NOC(CN3CCN(C/C=C(C)c4ccccc4)CC3)C1CO2 Homo sapiens CHEMBL644760 single protein format
CHEMBL1628227 OBDepict CH 3 N H 3 C O Ki = 32.0 nM 279.38 CN(C)CCC=C1c2ccccc2COc2ccccc21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL515331 OBDepict N O N NH O N N O O Ki = 36.0 nM 513.6 N#Cc1cccc(Oc2ncccc2C(=O)NCCN2CCCN(CC3COc4ccccc4O3)CC2)c1 Homo sapiens CHEMBL983548 cell-based format
CHEMBL516 OBDepict CH 3 N IC50 = 38.0 nM 287.41 CN1CCC(=C2c3ccccc3C=Cc3ccccc32)CC1 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL134 OBDepict Cl N Cl N H HN Ki = 38.0 nM 230.1 Clc1cccc(Cl)c1N=C1NCCN1 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL93489 OBDepict H 3 C O O CH 3 O N O N N Ki = 42.0 nM 449.55 COc1cc2c(cc1OC)C1=NOC(CN3CCN(C/C=C/c4ccccc4)CC3)C1CO2 Homo sapiens CHEMBL644760 single protein format
CHEMBL90419 OBDepict H 3 C O O CH 3 O N O N N Ki = 42.0 nM 451.57 COc1cc2c(cc1OC)C1=NOC(CN3CCN(CCCc4ccccc4)CC3)C1CO2 Homo sapiens CHEMBL644760 single protein format
CHEMBL445 OBDepict CH 3 N H Ki = 43.0 nM 263.38 CNCCC=C1c2ccccc2CCc2ccccc21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL723 OBDepict H 3 C O O N H HO O N H Ki = 43.0 nM 406.48 COc1ccccc1OCCNCC(O)COc1cccc2[nH]c3ccccc3c12 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL716 OBDepict HO O N N N S Ki = 45.8 nM 383.52 OCCOCCN1CCN(C2=Nc3ccccc3Sc3ccccc32)CC1 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL415 OBDepict H 3 C N H 3 C N Cl Ki = 46.0 nM 314.86 CN(C)CCCN1c2ccccc2CCc2ccc(Cl)cc21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL94129 OBDepict H 3 C O O CH 3 O N O N N Ki = 49.0 nM 473.57 COc1cc2c(cc1OC)C1=NOC(CN3CCN(Cc4ccc5ccccc5c4)CC3)C1CO2 Homo sapiens CHEMBL644760 single protein format
CHEMBL477816 OBDepict O N H N O N N O O Ki = 49.0 nM 488.59 O=C(NCCN1CCCN(CC2COc3ccccc3O2)CC1)c1cccnc1Oc1ccccc1 Homo sapiens CHEMBL983548 cell-based format
CHEMBL6437 OBDepict CH 3 N N IC50 = 52.0 nM 264.37 CN1CCN2c3ccccc3Cc3ccccc3C2C1 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL643 OBDepict H 3 C N CH 3 CH 3 N S IC50 = 53.0 nM 284.43 CC(CN1c2ccccc2Sc2ccccc21)N(C)C Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL51433 OBDepict CH 3 O N N N O N O H Ki = 56.0 nM 380.45 COc1ccccc1N1CCN(CCn2c(=O)[nH]c3ccccc3c2=O)CC1 Homo sapiens CHEMBL646283 single protein format
CHEMBL2413153 OBDepict F O N N N N O N CH 3 O Ki = 56.2 nM 405.47 Cn1c(=O)cnn(CCCCN2CCN(c3ccccc3OCCF)CC2)c1=O Homo sapiens CHEMBL2416740 single protein format
CHEMBL531 OBDepict CH 3 S H N H H CH 3 N H IC50 = 64.0 nM 314.5 CCCN1C[C@H](CSC)C[C@@H]2c3cccc4[nH]cc(c34)C[C@H]21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL1201203 OBDepict H O H N H CH 3 IC50 = 65.0 nM 307.44 CN1[C@H]2CC[C@@H]1C[C@H](OC(c1ccccc1)c1ccccc1)C2 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL420 OBDepict NH 2 N H NH N Cl Cl Ki = 68.0 nM 231.09 N=C(N)N/N=C/c1c(Cl)cccc1Cl Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL491419 OBDepict O N O N N O O Ki = 69.5 nM 475.59 c1ccc(Oc2ncccc2COCCN2CCCN(CC3COc4ccccc4O3)CC2)cc1 Homo sapiens CHEMBL983548 cell-based format
CHEMBL1628227 OBDepict CH 3 N H 3 C O IC50 = 71.0 nM 279.38 CN(C)CCC=C1c2ccccc2COc2ccccc21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL3343699 OBDepict F N N N N H N H Ki = 72.0 nM 219.22 Fc1ccc2cnn(N=C3NCCN3)c2c1 Homo sapiens CHEMBL3378315 cell-based format
CHEMBL179648 OBDepict N N O Ki = 72.8 nM 322.45 c1ccc(CN2CCN(CC3CCc4ccccc4O3)CC2)cc1 Homo sapiens CHEMBL983548 cell-based format
CHEMBL508112 OBDepict S N S S N S Ki = 74.0 nM 332.5 c1ccc2sc(SSc3nc4ccccc4s3)nc2c1 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL1186220 OBDepict HN NH N N N Ki = 79.0 nM 201.23 c1ccc2c(c1)cnn2N=C1NCCN1 Homo sapiens CHEMBL3378315 cell-based format
CHEMBL809 OBDepict H 3 C N H H H Cl Cl Ki = 82.8 nM 306.24 CN[C@H]1CC[C@@H](c2ccc(Cl)c(Cl)c2)c2ccccc21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL134 OBDepict Cl N Cl N H HN IC50 = 83.0 nM 230.1 Clc1cccc(Cl)c1N=C1NCCN1 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL723 OBDepict H 3 C O O N H HO O N H IC50 = 94.0 nM 406.48 COc1ccccc1OCCNCC(O)COc1cccc2[nH]c3ccccc3c12 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL445 OBDepict CH 3 N H IC50 = 94.0 nM 263.38 CNCCC=C1c2ccccc2CCc2ccccc21 Homo sapiens CHEMBL1909089 cell membrane format
CHEMBL92860 OBDepict H 3 C O O CH 3 O N O H H N N Ki = 95.0 nM 473.57 COc1cc2c(cc1OC)C1=NO[C@@H](CN3CCN(Cc4ccc5ccccc5c4)CC3)[C@@H]1CO2 Homo sapiens CHEMBL644760 single protein format
CHEMBL384925 OBDepict H 3 C N N N H CH 3 N Ki = 96.0 nM 422.58 Cc1nc2ccccc2c(Nc2ccc(N3CCN(C)CC3)cc2)c1Cc1ccccc1 Homo sapiens CHEMBL907693 cell-based format
CHEMBL284213 OBDepict H N N S Ki = 99.0 nM 204.3 c1nc(C2CCCc3sccc32)c[nH]1 Homo sapiens CHEMBL644762 single protein format