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P08173 | ACM4_HUMAN | Muscarinic acetylcholine receptor M4 (CHRM4)

3D structures mapped by conservation among orthologs

[ Domain: "Lysozyme-like" // Phage_lysozyme_2 ]

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[ Domain: "Family A G protein-coupled receptor-like" // 7tm_1_2 ]

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[ 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
CHEMBL3545181 OBDepict O O OH S S H H + N H H O CH 3 H 3 C H OH 2 _ Br Ki = 0.0078 nM 490.44 C[N+]1(C)[C@H]2C[C@H](OC(=O)C(O)(c3cccs3)c3cccs3)C[C@@H]1[C@H]1O[C@@H]21.O.[Br-] Homo sapiens CHEMBL1913684 cell-based format
CHEMBL71124 OBDepict H 3 C O + S _ O CH 3 N Ki = 0.07 nM 425.64 COc1ccc([S+]([O-])c2ccc(C(C)C3CCN(C4CCCCC4)CC3)cc2)cc1 Homo sapiens CHEMBL749865 single protein format
CHEMBL2114068 OBDepict CH 3 O + S _ O CH 2 N Ki = 0.09 nM 423.62 C=C(c1ccc([S@@+]([O-])c2ccc(OC)cc2)cc1)C1CCN(C2CCCCC2)CC1 Homo sapiens CHEMBL749865 single protein format
CHEMBL1201024 OBDepict HO H O O H H + N H H O CH 3 CH 3 H _ Br Ki = 0.098 nM 398.3 C[N+]1(C)[C@H]2C[C@H](OC(=O)[C@H](CO)c3ccccc3)C[C@H]1[C@H]1O[C@@H]21.[Br-] Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL1910856 OBDepict HO O N CH 3 H 3 C O H 2 N Ki = 0.115 nM 444.58 CC(C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)N1CC(Oc2cccc(O)c2)C1 Homo sapiens CHEMBL1913684 cell-based format
CHEMBL1231 OBDepict H 3 C N CH 3 O O HO Ki = 0.278 nM 357.49 CCN(CC)CC#CCOC(=O)C(O)(c1ccccc1)C1CCCCC1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL2115128 OBDepict CH 3 O + S _ O CH 2 N Ki = 0.32 nM 423.62 C=C(c1ccc([S@+]([O-])c2ccc(OC)cc2)cc1)C1CCN(C2CCCCC2)CC1 Homo sapiens CHEMBL749865 single protein format
CHEMBL71147 OBDepict CH 3 O S O O H 2 C N Ki = 0.33 nM 439.62 C=C(c1ccc(S(=O)(=O)c2ccc(OC)cc2)cc1)C1CCN(C2CCCCC2)CC1 Homo sapiens CHEMBL749865 single protein format
CHEMBL1201203 OBDepict H O H N H CH 3 Ki = 0.333 nM 307.44 CN1[C@H]2CC[C@@H]1C[C@H](OC(c1ccccc1)c1ccccc1)C2 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL517712 OBDepict OH O O H H N H H 3 C Ki = 0.34 nM 289.37 CN1[C@H]2CC[C@@H]1C[C@H](OC(=O)C(CO)c1ccccc1)C2 Homo sapiens CHEMBL749860 cell-based format
CHEMBL1464005 OBDepict OH O O H H + N H H 3 C H 3 C CH 3 _ Br Ki = 0.382 nM 412.37 CC(C)[N+]1(C)[C@H]2CC[C@@H]1C[C@H](OC(=O)C(CO)c1ccccc1)C2.[Br-] Homo sapiens CHEMBL1913684 cell-based format
CHEMBL14 OBDepict H 2 N O O + N H 3 C CH 3 CH 3 _ Cl IC50 = 0.4 nM 182.65 C[N+](C)(C)CCOC(N)=O.[Cl-] Homo sapiens CHEMBL749767 cell-based format
CHEMBL1123 OBDepict CH 3 N CH 3 O O Ki = 0.411 nM 309.49 CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL4853244 OBDepict H 3 C N N N N N H H H H N O IC50 = 0.44 nM 432.57 Cn1cc2cc(-c3ccc(N[C@H]4C[C@@H]5CN(CC6CCOCC6)C[C@@H]5C4)nn3)ccc2n1 Homo sapiens CHEMBL4839294 cell membrane format
CHEMBL76897 OBDepict O O + N CH 3 CH 3 _ I Ki = 0.66 nM 451.35 C[N+]1(C)CCC(OC(=O)C(c2ccccc2)c2ccccc2)CC1.[I-] Homo sapiens CHEMBL947360 single protein format
CHEMBL1201024 OBDepict HO H O O H H + N H H O CH 3 CH 3 H _ Br IC50 = 0.706 nM 398.3 C[N+]1(C)[C@H]2C[C@H](OC(=O)[C@H](CO)c3ccccc3)C[C@H]1[C@H]1O[C@@H]21.[Br-] Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL629 OBDepict CH 3 N CH 3 Ki = 0.739 nM 277.41 CN(C)CCC=C1c2ccccc2CCc2ccccc21 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL517712 OBDepict OH O O H H N H H 3 C IC50 = 0.744 nM 289.37 CN1[C@H]2CC[C@@H]1C[C@H](OC(=O)C(CO)c1ccccc1)C2 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL1490 OBDepict OH N Ki = 0.764 nM 301.47 OC(CCN1CCCCC1)(c1ccccc1)C1CCCCC1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL326450 OBDepict CH 3 N H O O CH 3 N O O H 3 C Ki = 1.0 nM 434.54 CCCCc1[nH]c2ccc3c(c2c1C(=O)OCC)CN1CCc2cc(OC)ccc2C1O3 Homo sapiens CHEMBL2317635 single protein format
CHEMBL643 OBDepict H 3 C N CH 3 CH 3 N S Ki = 1.057 nM 284.43 CC(CN1c2ccccc2Sc2ccccc21)N(C)C Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL2377267 OBDepict CH 3 N CH 3 O O OH S Ki = 1.49 nM 339.5 CCN(CC)CCOC(=O)C(O)(c1cccs1)C1CCCCC1 Homo sapiens CHEMBL2380032 cell-based format
CHEMBL286008 OBDepict CH 3 N CH 3 O O CH 3 Ki = 1.5 nM 317.47 CN(C)CCCOC(=O)C(C)(c1ccccc1)C1CCCCC1 Homo sapiens CHEMBL749859 single protein format
CHEMBL76897 OBDepict O O + N CH 3 CH 3 _ I IC50 = 1.9 nM 451.35 C[N+]1(C)CCC(OC(=O)C(c2ccccc2)c2ccccc2)CC1.[I-] Homo sapiens CHEMBL857679 single protein format
CHEMBL1231 OBDepict H 3 C N CH 3 O O HO IC50 = 1.994 nM 357.49 CCN(CC)CC#CCOC(=O)C(O)(c1ccccc1)C1CCCCC1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL516 OBDepict CH 3 N Ki = 2.186 nM 287.41 CN1CCC(=C2c3ccccc3C=Cc3ccccc32)CC1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL307810 OBDepict H 3 C O + S _ O N CH 3 N Ki = 2.2 nM 426.63 COc1ccc([S+]([O-])c2ccc(C(C)N3CCN(C4CCCCC4)CC3)cc2)cc1 Homo sapiens CHEMBL749865 single protein format
CHEMBL4519301 OBDepict F N O O N Ki = 2.2 nM 368.45 O=C(OC1CN2CCC1CC2)N(CCc1ccc(F)cc1)c1ccccc1 Homo sapiens CHEMBL4373118 cell-based format
CHEMBL376897 OBDepict HO H O O H H + N H H O CH 3 CH 3 H IC50 = 2.3 nM 318.39 C[N+]1(C)[C@H]2C[C@H](OC(=O)[C@H](CO)c3ccccc3)C[C@@H]1[C@H]1O[C@@H]21 Homo sapiens CHEMBL749767 cell-based format
CHEMBL1201203 OBDepict H O H N H CH 3 IC50 = 2.385 nM 307.44 CN1[C@H]2CC[C@@H]1C[C@H](OC(c1ccccc1)c1ccccc1)C2 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL1626 OBDepict Cl O CH 3 H N CH 3 Ki = 2.773 nM 343.9 CN1CCC[C@@H]1CCO[C@](C)(c1ccccc1)c1ccc(Cl)cc1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL1123 OBDepict CH 3 N CH 3 O O IC50 = 2.947 nM 309.49 CCN(CC)CCOC(=O)C1(C2CCCCC2)CCCCC1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL1382 OBDepict CH 3 HO H N CH 3 CH 3 CH 3 H 3 C Ki = 3.1 nM 325.5 Cc1ccc(O)c([C@H](CCN(C(C)C)C(C)C)c2ccccc2)c1 Homo sapiens CHEMBL932205 cell-based format
CHEMBL1200604 OBDepict CH 3 N O HO N Ki = 3.483 nM 284.36 CCN(Cc1ccncc1)C(=O)C(CO)c1ccccc1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL2107687 OBDepict CH 3 H 3 C O O + N CH 3 H 3 C H 3 C _ Br Ki = 3.669 nM 386.37 CCC(C)C(C(=O)OCC[N+](C)(CC)CC)c1ccccc1.[Br-] Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL284137 OBDepict CH 3 N CH 3 O O CH 3 Ki = 4.6 nM 345.53 CCN(CC)CCCOC(=O)C(C)(c1ccccc1)C1CCCCC1 Homo sapiens CHEMBL749859 single protein format
CHEMBL629 OBDepict CH 3 N CH 3 IC50 = 5.297 nM 277.41 CN(C)CCC=C1c2ccccc2CCc2ccccc21 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL1490 OBDepict OH N IC50 = 5.478 nM 301.47 OC(CCN1CCCCC1)(c1ccccc1)C1CCCCC1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL1628227 OBDepict CH 3 N H 3 C O Ki = 5.842 nM 279.38 CN(C)CCC=C1c2ccccc2COc2ccccc21 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL42 OBDepict H 3 C N N N NH Cl Ki = 6.303 nM 326.83 CN1CCN(C2=Nc3cc(Cl)ccc3Nc3ccccc32)CC1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL4790083 OBDepict N N N N O S O O S N Ki = 6.5 nM 467.58 N#Cc1ccc(N2C3CCC2CN(C(=O)CCS(=O)(=O)c2cccc4ncsc24)C3)nc1 Homo sapiens CHEMBL4679800 cell-based format
CHEMBL1092 OBDepict OH N ClH IC50 = 6.7 nM 337.94 Cl.OC(CCN1CCCCC1)(c1ccccc1)C1CCCCC1 Homo sapiens CHEMBL749766 cell-based format
CHEMBL2377387 OBDepict CH 3 N H 3 C S O OH Ki = 7.23 nM 343.49 CCN(CC)CCSC(=O)C(O)(c1ccccc1)c1ccccc1 Homo sapiens CHEMBL2380032 cell-based format
CHEMBL26505 OBDepict CH 3 N H 3 C O O CH 3 Ki = 7.4 nM 325.45 CCN(CC)CCOC(=O)C(C)(c1ccccc1)c1ccccc1 Homo sapiens CHEMBL749859 single protein format
CHEMBL643 OBDepict H 3 C N CH 3 CH 3 N S IC50 = 7.576 nM 284.43 CC(CN1c2ccccc2Sc2ccccc21)N(C)C Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL4071900 OBDepict H 3 C O N S CH 3 N O O N N N N CH 3 H 3 C Ki = 7.78 nM 434.57 Cc1noc(C)c1S(=O)(=O)N1CCN(c2ccc(N3CCCC(C)(C)C3)nn2)CC1 Homo sapiens CHEMBL4056096 cell-based format
CHEMBL1909073 OBDepict H 3 C + N O O OH _ Br Ki = 8.584 nM 448.4 CC[N+]1(CCOC(=O)C(O)(c2ccccc2)c2ccccc2)CCCCC1.[Br-] Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL1346 OBDepict H 2 N O H N O Ki = 8.6 nM 426.56 NC(=O)C(c1ccccc1)(c1ccccc1)[C@@H]1CCN(CCc2ccc3c(c2)CCO3)C1 Homo sapiens CHEMBL749860 cell-based format
CHEMBL71531 OBDepict CH 3 O S O O O N Ki = 9.05 nM 441.59 COc1ccc(S(=O)(=O)c2ccc(C(=O)C3CCN(C4CCCCC4)CC3)cc2)cc1 Homo sapiens CHEMBL749865 single protein format
CHEMBL2377269 OBDepict CH 3 N CH 3 O O HO Ki = 9.48 nM 333.47 CCN(CC)CCOC(=O)C(c1ccccc1)C1(O)CCCCC1 Homo sapiens CHEMBL2380032 cell-based format
CHEMBL477542 OBDepict NH 2 HN NH O NH 2 N H NH NH 2 IC50 = 10.0 nM 327.48 N=C(N)NCCCCCCCCC(=O)C(N)CCCNC(=N)N Homo sapiens CHEMBL1025829 single protein format
CHEMBL4059829 OBDepict F F O N N N N O Ki = 10.3 nM 450.49 O=C(C1CCN(c2cc(Oc3ccc(F)cc3F)ncn2)CC1)N1CCc2ccccc2C1 Homo sapiens CHEMBL4018271 cell-based format
CHEMBL479 OBDepict H 3 C S N S N CH 3 Ki = 11.0 nM 370.59 CSc1ccc2c(c1)N(CCC1CCCCN1C)c1ccccc1S2 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL2114064 OBDepict H 3 C O + S _ O N N Ki = 12.74 nM 436.62 COc1ccc([S@@+]([O-])c2ccc(C(C#N)C3CCN(C4CCCCC4)CC3)cc2)cc1 Homo sapiens CHEMBL749865 single protein format
CHEMBL415 OBDepict H 3 C N H 3 C N Cl Ki = 13.0 nM 314.86 CN(C)CCCN1c2ccccc2CCc2ccc(Cl)cc21 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL445 OBDepict CH 3 N H Ki = 13.0 nM 263.38 CNCCC=C1c2ccccc2CCc2ccccc21 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL2106570 OBDepict H 3 C + N CH 3 CH 3 O O HO _ Br Ki = 13.2 nM 422.36 CC[N+](C)(CC)CCOC(=O)C(O)(c1ccccc1)c1ccccc1.[Br-] Homo sapiens CHEMBL2380032 cell-based format
CHEMBL1319362 OBDepict OH O O H H N H H 3 C BrH Ki = 14.0 nM 356.26 Br.CN1[C@H]2CC[C@@H]1C[C@H](OC(=O)C(O)c1ccccc1)C2 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL2111540 OBDepict H 3 C O + S _ O N N N Ki = 14.8 nM 437.61 COc1ccc([S@@+]([O-])c2ccc(C(C#N)N3CCN(C4CCCCC4)CC3)cc2)cc1 Homo sapiens CHEMBL749865 single protein format
CHEMBL334255 OBDepict CH 3 + N _ Br Ki = 15.0 nM 384.45 CCCCCCCCCCCCCCCC[n+]1ccccc1.[Br-] Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL2115127 OBDepict H 3 C O + S _ O O N Ki = 15.2 nM 425.59 COc1ccc([S@+]([O-])c2ccc(C(=O)C3CCN(C4CCCCC4)CC3)cc2)cc1 Homo sapiens CHEMBL749865 single protein format
CHEMBL516 OBDepict CH 3 N IC50 = 16.0 nM 287.41 CN1CCC(=C2c3ccccc3C=Cc3ccccc32)CC1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL900 OBDepict CH 3 N H 3 C O CH 3 Ki = 17.0 nM 269.39 Cc1ccccc1C(OCCN(C)C)c1ccccc1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL2114067 OBDepict H 3 C O + S _ O O N Ki = 17.9 nM 425.59 COc1ccc([S@@+]([O-])c2ccc(C(=O)C3CCN(C4CCCCC4)CC3)cc2)cc1 Homo sapiens CHEMBL749865 single protein format
CHEMBL2114066 OBDepict H 3 C O + S _ O N N N Ki = 18.4 nM 437.61 COc1ccc([S@+]([O-])c2ccc(C(C#N)N3CCN(C4CCCCC4)CC3)cc2)cc1 Homo sapiens CHEMBL749865 single protein format
CHEMBL443780 OBDepict CH 3 N H 3 C O O CH 3 Ki = 18.5 nM 331.5 CCN(CC)CCOC(=O)C(C)(c1ccccc1)C1CCCCC1 Homo sapiens CHEMBL749859 single protein format
CHEMBL71971 OBDepict CH 3 O S O O N N N Ki = 18.6 nM 453.61 COc1ccc(S(=O)(=O)c2ccc(C(C#N)N3CCN(C4CCCCC4)CC3)cc2)cc1 Homo sapiens CHEMBL749865 single protein format
CHEMBL395110 OBDepict CH 3 N N S Ki = 19.0 nM 310.47 CN1CCCC(CN2c3ccccc3Sc3ccccc32)C1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL1626 OBDepict Cl O CH 3 H N CH 3 IC50 = 20.0 nM 343.9 CN1CCC[C@@H]1CCO[C@](C)(c1ccccc1)c1ccc(Cl)cc1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL71 OBDepict CH 3 N CH 3 N S Cl Ki = 21.0 nM 318.87 CN(C)CCCN1c2ccccc2Sc2ccc(Cl)cc21 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL519609 OBDepict CH 3 N CH 3 O N O S Ki = 21.0 nM 356.49 CCN(CC)CCCOC(=O)N1c2ccccc2Sc2ccccc21 Homo sapiens CHEMBL2404428 single protein format
CHEMBL715 OBDepict CH 3 N N N S N H CH 3 Ki = 22.0 nM 312.44 Cc1cc2c(s1)Nc1ccccc1N=C2N1CCN(C)CC1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL12587 OBDepict CH 3 + N CH 3 H 3 C H O H CH 3 H OH Ki = 23.0 nM 174.26 C[C@@H]1O[C@H](C[N+](C)(C)C)C[C@H]1O Homo sapiens CHEMBL749863 cell-based format
CHEMBL14 OBDepict H 2 N O O + N H 3 C CH 3 CH 3 _ Cl Ki = 24.0 nM 182.65 C[N+](C)(C)CCOC(N)=O.[Cl-] Homo sapiens CHEMBL749863 cell-based format
CHEMBL1200604 OBDepict CH 3 N O HO N IC50 = 25.0 nM 284.36 CCN(Cc1ccncc1)C(=O)C(CO)c1ccccc1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL4585326 OBDepict H 3 C O N O O N Ki = 25.0 nM 380.49 COc1ccc(CCN(C(=O)OC2CN3CCC2CC3)c2ccccc2)cc1 Homo sapiens CHEMBL4373118 cell-based format
CHEMBL2107687 OBDepict CH 3 H 3 C O O + N CH 3 H 3 C H 3 C _ Br IC50 = 26.0 nM 386.37 CCC(C)C(C(=O)OCC[N+](C)(CC)CC)c1ccccc1.[Br-] Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL7303 OBDepict CH 3 O O N CH 3 Ki = 26.0 nM 155.2 COC(=O)C1=CCCN(C)C1 Homo sapiens CHEMBL749863 cell-based format
CHEMBL1101 OBDepict OH N Ki = 32.1 nM 311.47 OC(CCN1CCCCC1)(c1ccccc1)C1CC2C=CC1C2 Homo sapiens CHEMBL2380032 cell-based format
CHEMBL64000 OBDepict H 3 C O O HN Ki = 33.0 nM 169.22 CC(=O)OC1CC2CCCC1N2 Homo sapiens CHEMBL749864 cell-based format
CHEMBL490 OBDepict F H H HN O O O Ki = 34.0 nM 329.37 Fc1ccc([C@@H]2CCNC[C@H]2COc2ccc3c(c2)OCO3)cc1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL221753 OBDepict CH 3 CH 3 CH 3 CH 3 CH 3 O O + N H 3 C CH 3 _ Cl Ki = 36.0 nM 448.09 CC(C)(C)CC(C)(C)c1ccc(OCCOCC[N+](C)(C)Cc2ccccc2)cc1.[Cl-] Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL1187846 OBDepict HO H O O H H N H CH 3 H O H Ki = 36.9 nM 303.36 CN1[C@H]2C[C@H](OC(=O)[C@H](CO)c3ccccc3)C[C@@H]1[C@@H]1O[C@H]12 Homo sapiens CHEMBL2320129 cell-based format
CHEMBL27673 OBDepict CH 3 O NH N H N H N H O CH 3 Ki = 38.0 nM 582.92 COc1ccccc1CNCCCCCCNCCCCCCCCNCCCCCCNCc1ccccc1OC Homo sapiens CHEMBL749857 cell-based format
CHEMBL936 OBDepict HO N Ki = 38.0 nM 309.45 OC(CCCN1CCCCC1)(c1ccccc1)c1ccccc1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL1628227 OBDepict CH 3 N H 3 C O IC50 = 42.0 nM 279.38 CN(C)CCC=C1c2ccccc2COc2ccccc21 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL564 OBDepict CH 3 N CH 3 N S Ki = 42.0 nM 284.43 CN(C)CCCN1c2ccccc2Sc2ccccc21 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL314493 OBDepict O O O N Cl Cl Cl H 3 C Ki = 42.0 nM 316.61 CN1C2CCCC1C(OC(=O)OCC(Cl)(Cl)Cl)C2 Homo sapiens CHEMBL749864 cell-based format
CHEMBL42 OBDepict H 3 C N N N NH Cl IC50 = 45.0 nM 326.83 CN1CCN(C2=Nc3cc(Cl)ccc3Nc3ccccc32)CC1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL2115126 OBDepict H 3 C O + S _ O N N Ki = 45.05 nM 436.62 COc1ccc([S@+]([O-])c2ccc(C(C#N)C3CCN(C4CCCCC4)CC3)cc2)cc1 Homo sapiens CHEMBL749865 single protein format
CHEMBL1172 OBDepict Cl N N H Ki = 47.0 nM 310.83 Clc1ccc2c(c1)CCc1cccnc1C2=C1CCNCC1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL315428 OBDepict O O N H + N O _ O Ki = 48.0 nM 276.29 O=C(OC1CC2CCCC1N2)c1ccc([N+](=O)[O-])cc1 Homo sapiens CHEMBL749864 cell-based format
CHEMBL135645 OBDepict H 3 C O N N N IC50 = 49.0 nM 193.25 CO/N=C(C#N)C12CCCN(CC1)C2 Homo sapiens CHEMBL749239 single protein format
CHEMBL657 OBDepict CH 3 N CH 3 O Ki = 52.0 nM 255.36 CN(C)CCOC(c1ccccc1)c1ccccc1 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL481153 OBDepict O N O S N Ki = 54.0 nM 340.45 O=C(OCCN1CCCC1)N1c2ccccc2Sc2ccccc21 Homo sapiens CHEMBL2404428 single protein format
CHEMBL21731 OBDepict CH 3 N H Ki = 58.0 nM 277.41 CNCCCC12CCC(c3ccccc31)c1ccccc12 Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL12098 OBDepict Cl S O O N N O NH 2 H 3 C Ki = 61.0 nM 566.17 Cc1cccc(C(=O)N2CCC(N3CCC(Cc4ccc(S(=O)(=O)c5cccc(Cl)c5)cc4)CC3)CC2)c1N Homo sapiens CHEMBL2317635 single protein format
CHEMBL332980 OBDepict OH O O OH H 3 C N O O IC50 = 62.0 nM 403.48 CCN1CCC(c2ccccc2)=C(C(=O)OC2CCCCC2)C1.O=C(O)C(=O)O Homo sapiens CHEMBL749237 cell-based format
CHEMBL1909073 OBDepict H 3 C + N O O OH _ Br IC50 = 62.0 nM 448.4 CC[N+]1(CCOC(=O)C(O)(c2ccccc2)c2ccccc2)CCCCC1.[Br-] Homo sapiens CHEMBL1909173 cell membrane format
CHEMBL285440 OBDepict CH 3 N H 3 C O O H 3 C Ki = 65.6 nM 331.5 CN(C)CCCCOC(=O)C(C)(c1ccccc1)C1CCCCC1 Homo sapiens CHEMBL749859 single protein format