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P23526 | SAHH_HUMAN | Adenosylhomocysteinase (AHCY)

3D structures mapped by conservation among orthologs

[ Domain: "NAD(P)-binding Rossmann-fold domains" // AdoHcyase_NAD ]

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[ Domain: "Formate/glycerate dehydrogenase catalytic domain-like" // AdoHcyase ]

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[ Domain: pdbs with more than 2 multi-domains ]

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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
CHEMBL280595 OBDepict O N O N N H 2 C O N NH 2 Ki = 0.5 nM 247.21 C=C(C=O)OC(C=O)n1cnc2c(N)ncnc21 Homo sapiens CHEMBL800464 single protein format
CHEMBL3322562 OBDepict CH 3 NH HN O N O N O Cl N CH 3 Cl ClH Ki = 1.5 nM 592.96 CNCCNC(=O)CN(CC(=O)N(C)N1Cc2ccccc2C1)c1cc(Cl)ccc1Oc1ccc(Cl)cc1.Cl Homo sapiens CHEMBL3367519 single protein format
CHEMBL281476 OBDepict O N O N N O HO N NH 2 Ki = 3.3 nM 265.23 Nc1ncnc2c1ncn2C(C=O)OC(C=O)CO Homo sapiens CHEMBL803315 single protein format
CHEMBL8771 OBDepict HO H HO H N H HO N N N NH 2 Ki = 3.8 nM 263.26 Nc1ncnc2c1ncn2[C@@H]1C=C(CO)[C@@H](O)[C@H]1O Homo sapiens CHEMBL804128 assay format
CHEMBL268272 OBDepict HO H H HO H N H HO N N NH 2 Ki = 4.0 nM 264.29 Nc1nccc2c1ncn2[C@@H]1C[C@H](CO)[C@@H](O)[C@H]1O Homo sapiens CHEMBL798962 single protein format
CHEMBL3322562 OBDepict CH 3 NH HN O N O N O Cl N CH 3 Cl ClH IC50 = 5.0 nM 592.96 CNCCNC(=O)CN(CC(=O)N(C)N1Cc2ccccc2C1)c1cc(Cl)ccc1Oc1ccc(Cl)cc1.Cl Homo sapiens CHEMBL3367518 single protein format
CHEMBL2115462 OBDepict HO H H F H HO H N H HO N N N NH 2 IC50 = 8.0 nM 283.26 Nc1ncnc2c1ncn2[C@H]1[C@H](O)[C@H](O)[C@@H](CO)[C@H]1F Homo sapiens CHEMBL800621 assay format
CHEMBL301499 OBDepict NH 2 N N N N H H OH H HO Ki = 12.0 nM 235.25 Nc1ncnc2c1ncn2[C@@H]1CC[C@@H](O)[C@H]1O Homo sapiens CHEMBL804129 assay format
CHEMBL3322547 OBDepict O NH N N O N O Cl N CH 3 Cl IC50 = 13.0 nM 596.56 CN(C(=O)CN(CC(=O)NCCN1CCCC1)c1cc(Cl)ccc1Oc1ccc(Cl)cc1)N1Cc2ccccc2C1 Homo sapiens CHEMBL3367518 single protein format
CHEMBL3290658 OBDepict H N H OH H HO N Cl N NH 2 IC50 = 16.0 nM 268.7 Nc1ncc(Cl)c2c1ncn2[C@@H]1CC[C@@H](O)[C@H]1O Homo sapiens CHEMBL3294635 single protein format
CHEMBL281337 OBDepict HO H H HO H N H HO N N NH 2 IC50 = 18.0 nM 264.29 Nc1ccnc2c1ncn2[C@@H]1C[C@H](CO)[C@@H](O)[C@H]1O Homo sapiens CHEMBL800629 single protein format
CHEMBL50728 OBDepict CH 2 H H OH H N H HO N N N H 2 N Ki = 22.0 nM 261.29 C=C[C@H]1C[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O Homo sapiens CHEMBL804129 assay format
CHEMBL3290663 OBDepict NH 2 N N N F H H OH H HO H HO IC50 = 24.0 nM 268.25 Nc1ncc(F)c2c1ncn2[C@@H]1C[C@H](O)[C@@H](O)[C@H]1O Homo sapiens CHEMBL3294635 single protein format
CHEMBL50306 OBDepict NH 2 N N N N H H OH H H 3 C H HO Ki = 27.0 nM 249.27 C[C@H]1C[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O Homo sapiens CHEMBL804129 assay format
CHEMBL3290665 OBDepict H N H OH H HO N F N NH 2 IC50 = 28.0 nM 250.23 Nc1ncc(F)c2c1ncn2[C@@H]1C=C[C@@H](O)[C@H]1O Homo sapiens CHEMBL3294636 cell-based format
CHEMBL284846 OBDepict NH 2 N N N HO HO OH IC50 = 31.0 nM 262.27 Nc1nccc2c1ncn2C1C=C(CO)C(O)C1O Homo sapiens CHEMBL800629 single protein format
CHEMBL308037 OBDepict O H O H HO H N H HO N N N NH 2 Ki = 39.0 nM 265.23 Nc1ncnc2c1ncn2[C@@H]1O[C@H](C=O)[C@@H](O)[C@H]1O Homo sapiens CHEMBL801948 single protein format
CHEMBL3290657 OBDepict H N H OH H HO N F N NH 2 IC50 = 40.0 nM 252.25 Nc1ncc(F)c2c1ncn2[C@@H]1CC[C@@H](O)[C@H]1O Homo sapiens CHEMBL3294635 single protein format
CHEMBL77518 OBDepict O H O H HO H N H HO N N N NH 2 Ki = 43.0 nM 265.23 Nc1ncnc2c1ncn2[C@@H]1O[C@@H](C=O)[C@@H](O)[C@H]1O Homo sapiens CHEMBL801948 single protein format
CHEMBL299961 OBDepict NH 2 N N N N H H OH H HO Ki = 49.0 nM 233.23 Nc1ncnc2c1ncn2[C@@H]1C=C[C@@H](O)[C@H]1O Homo sapiens CHEMBL804129 assay format
CHEMBL3322556 OBDepict H 3 C N H CH 3 HN O N O N O Cl CH 3 Cl IC50 = 49.0 nM 583.56 CC(C)NCCNC(=O)CN(CC(=O)N(C)C1Cc2ccccc2C1)c1cc(Cl)ccc1Oc1ccc(Cl)cc1 Homo sapiens CHEMBL3367518 single protein format
CHEMBL3322540 OBDepict O NH N N O N O Cl CH 3 Cl IC50 = 52.0 nM 595.57 CN(C(=O)CN(CC(=O)NCCN1CCCC1)c1cc(Cl)ccc1Oc1ccc(Cl)cc1)C1Cc2ccccc2C1 Homo sapiens CHEMBL3367518 single protein format
CHEMBL301499 OBDepict NH 2 N N N N H H OH H HO IC50 = 55.0 nM 235.25 Nc1ncnc2c1ncn2[C@@H]1CC[C@@H](O)[C@H]1O Homo sapiens CHEMBL3294635 single protein format
CHEMBL3322555 OBDepict CH 3 HN N H O N O N O Cl CH 3 Cl IC50 = 60.0 nM 569.53 CCNCCNC(=O)CN(CC(=O)N(C)C1Cc2ccccc2C1)c1cc(Cl)ccc1Oc1ccc(Cl)cc1 Homo sapiens CHEMBL3367518 single protein format
CHEMBL3322554 OBDepict CH 3 NH HN O N O N O Cl CH 3 Cl IC50 = 70.0 nM 555.51 CNCCNC(=O)CN(CC(=O)N(C)C1Cc2ccccc2C1)c1cc(Cl)ccc1Oc1ccc(Cl)cc1 Homo sapiens CHEMBL3367518 single protein format
CHEMBL53931 OBDepict OH OH H 2 C HO N N N N H 2 N IC50 = 80.0 nM 277.28 C=C1C(CO)C(O)C(O)C1n1cnc2c(N)ncnc21 Homo sapiens CHEMBL800621 assay format
CHEMBL296880 OBDepict H HO OH N N N NH 2 Ki = 90.0 nM 234.26 Nc1nccc2c1ncn2C/C=C[C@@H](O)CO Homo sapiens CHEMBL800520 assay format
CHEMBL606276 OBDepict H 3 C O N H O H HO N H OH N N N NH 2 Ki = 94.6 nM 294.27 CO/N=C/[C@H]1OC(n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O Homo sapiens CHEMBL801948 single protein format
CHEMBL608056 OBDepict I H O H OH N H HO N N N H 2 N Ki = 96.0 nM 389.15 Nc1ncnc2c1ncn2C1O[C@H](/C=C/I)[C@@H](O)[C@H]1O Homo sapiens CHEMBL801946 assay format
CHEMBL3290655 OBDepict F N N H 2 N N N H H HO H OH IC50 = 98.0 nM 253.24 Nc1nc(F)nc2c1ncn2[C@@H]1CC[C@@H](O)[C@H]1O Homo sapiens CHEMBL3294636 cell-based format
CHEMBL605902 OBDepict NH 2 N N N N O H OH H H HO N O Ki = 101.0 nM 370.37 Nc1ncnc2c1ncn2C1O[C@H](/C=N/OCc2ccccc2)[C@@H](O)[C@H]1O Homo sapiens CHEMBL801948 single protein format
CHEMBL49935 OBDepict HO H H HO H N H HO N N N NH 2 Ki = 110.0 nM 265.27 Nc1ncnc2c1ncn2[C@@H]1C[C@H](CO)[C@@H](O)[C@H]1O Homo sapiens CHEMBL798962 single protein format
CHEMBL3322559 OBDepict O HN N H N H O N O Cl CH 3 Cl IC50 = 110.0 nM 581.54 CN(C(=O)CN(CC(=O)NC[C@@H]1CCCN1)c1cc(Cl)ccc1Oc1ccc(Cl)cc1)C1Cc2ccccc2C1 Homo sapiens CHEMBL3367518 single protein format
CHEMBL2092790 OBDepict Cl H O H HO H N H HO N N N NH 2 Ki = 110.0 nM 297.7 Nc1ncnc2c1ncn2[C@@H]1O[C@H](/C=C/Cl)[C@@H](O)[C@H]1O Homo sapiens CHEMBL801946 assay format
CHEMBL49908 OBDepict HO HO N N N N NH 2 Ki = 110.0 nM 235.25 Nc1ncnc2c1ncn2CC=C(CO)CO Homo sapiens CHEMBL800520 assay format
CHEMBL605900 OBDepict H 3 C O N H O H OH N H HO N N N H 2 N Ki = 111.0 nM 308.3 CCO/N=C/[C@H]1OC(n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O Homo sapiens CHEMBL801948 single protein format
CHEMBL45537 OBDepict HO N N N N NH 2 Ki = 125.0 nM 205.22 Nc1ncnc2c1ncn2C/C=CCO Homo sapiens CHEMBL800520 assay format
CHEMBL3322553 OBDepict CH 3 N H 3 C NH O N O N O Cl CH 3 Cl IC50 = 130.0 nM 569.53 CN(C)CCNC(=O)CN(CC(=O)N(C)C1Cc2ccccc2C1)c1cc(Cl)ccc1Oc1ccc(Cl)cc1 Homo sapiens CHEMBL3367518 single protein format
CHEMBL2092789 OBDepict Br H O H HO H N H HO N N N NH 2 Ki = 134.0 nM 342.15 Nc1ncnc2c1ncn2[C@@H]1O[C@H](/C=C/Br)[C@@H](O)[C@H]1O Homo sapiens CHEMBL801946 assay format
CHEMBL3322561 OBDepict O N H N HN O N O Cl CH 3 Cl IC50 = 150.0 nM 595.57 CN(C(=O)CN(CC(=O)NCC1CCCCN1)c1cc(Cl)ccc1Oc1ccc(Cl)cc1)C1Cc2ccccc2C1 Homo sapiens CHEMBL3367518 single protein format
CHEMBL49511 OBDepict NH 2 N N N HO Ki = 160.0 nM 202.22 Nc1nccc2c1ncn2CC#CCO Homo sapiens CHEMBL800520 assay format
CHEMBL129014 OBDepict NH 2 N N N N H H OH H HO H HO Ki = 160.0 nM 251.25 Nc1ncnc2c1ncn2[C@@H]1C[C@H](O)[C@@H](O)[C@H]1O Homo sapiens CHEMBL803156 single protein format
CHEMBL50600 OBDepict HO HO N N N NH 2 Ki = 166.0 nM 234.26 Nc1nccc2c1ncn2CC=C(CO)CO Homo sapiens CHEMBL800520 assay format
CHEMBL415930 OBDepict OH H 3 C N N N N NH 2 Ki = 170.0 nM 219.25 C/C(=C/Cn1cnc2c(N)ncnc21)CO Homo sapiens CHEMBL800520 assay format
CHEMBL2115031 OBDepict HO H H F H HO H N H HO N N N NH 2 IC50 = 180.0 nM 283.26 Nc1ncnc2c1ncn2[C@H]1[C@H](O)[C@H](O)[C@@H](CO)[C@@H]1F Homo sapiens CHEMBL800621 assay format
CHEMBL3290660 OBDepict F N F NH 2 N N H H OH H HO IC50 = 189.0 nM 270.24 Nc1nc(F)c(F)c2c1ncn2[C@@H]1CC[C@@H](O)[C@H]1O Homo sapiens CHEMBL3294636 cell-based format
CHEMBL419393 OBDepict Cl H HO H N H HO N N N NH 2 IC50 = 195.0 nM 281.7 Nc1ncnc2c1ncn2[C@@H]1C=C(CCl)[C@@H](O)[C@H]1O Homo sapiens CHEMBL3294635 single protein format
CHEMBL49737 OBDepict NH 2 N N N OH Ki = 200.0 nM 204.23 Nc1nccc2c1ncn2C/C=CCO Homo sapiens CHEMBL800520 assay format
CHEMBL416457 OBDepict HO HO H N N N N NH 2 Ki = 200.0 nM 235.25 Nc1ncnc2c1ncn2C/C=C[C@@H](O)CO Homo sapiens CHEMBL800520 assay format
CHEMBL3349025 OBDepict OH N H O H HO H N H HO N N N NH 2 Ki = 224.0 nM 280.24 Nc1ncnc2c1ncn2[C@@H]1O[C@@H](C=NO)[C@@H](O)[C@H]1O Homo sapiens CHEMBL801948 single protein format
CHEMBL3290659 OBDepict H N H HO H OH N CH 3 N H 2 N IC50 = 236.0 nM 248.29 Cc1cnc(N)c2ncn([C@@H]3CC[C@@H](O)[C@H]3O)c12 Homo sapiens CHEMBL3294635 single protein format
CHEMBL3290650 OBDepict H H OH N H HO N N NH 2 IC50 = 250.0 nM 234.26 Nc1nccn2c([C@@H]3CC[C@@H](O)[C@H]3O)cnc12 Homo sapiens CHEMBL3294635 single protein format
CHEMBL3290662 OBDepict NH 2 N N N F H H OH H F H HO IC50 = 269.0 nM 270.24 Nc1ncc(F)c2c1ncn2[C@@H]1C[C@H](F)[C@@H](O)[C@H]1O Homo sapiens CHEMBL3294635 single protein format
CHEMBL77965 OBDepict O H H HO H N H HO N N N NH 2 Ki = 273.0 nM 263.26 Nc1ncnc2c1ncn2[C@@H]1C[C@@H](C=O)[C@@H](O)[C@H]1O Homo sapiens CHEMBL803155 assay format
CHEMBL494759 OBDepict HO HO H N N N N NH 2 IC50 = 280.0 nM 209.21 Nc1ncnc2c1ncn2C[C@H](O)CO Homo sapiens CHEMBL800629 single protein format
CHEMBL49935 OBDepict HO H H HO H N H HO N N N NH 2 IC50 = 303.0 nM 265.27 Nc1ncnc2c1ncn2[C@@H]1C[C@H](CO)[C@@H](O)[C@H]1O Homo sapiens CHEMBL3294635 single protein format
CHEMBL610148 OBDepict Cl O O H O H OH N H HO N N N H 2 N Ki = 320.0 nM 343.73 Nc1ncnc2c1ncn2C1O[C@H](C(=O)OCCCl)[C@@H](O)[C@H]1O Homo sapiens CHEMBL857626 single protein format
CHEMBL49917 OBDepict HO N N N N NH 2 Ki = 330.0 nM 205.22 Nc1ncnc2c1ncn2C/C=C/CO Homo sapiens CHEMBL800520 assay format
CHEMBL3322534 OBDepict O NH N N O N O Cl H 3 C Cl IC50 = 340.0 nM 583.56 CN(CCc1ccccc1)C(=O)CN(CC(=O)NCCN1CCCC1)c1cc(Cl)ccc1Oc1ccc(Cl)cc1 Homo sapiens CHEMBL3367518 single protein format
CHEMBL4638533 OBDepict HO H H F H OH H N H OH N N N H 2 N IC50 = 360.0 nM 297.29 Nc1ncnc2c1ncn2[C@H]1[C@H](O)[C@H](O)[C@@H](CCO)[C@H]1F Homo sapiens CHEMBL4604199 assay format
CHEMBL612224 OBDepict O O H O H OH N H OH N N N NH 2 Ki = 360.0 nM 371.35 Nc1ncnc2c1ncn2C1O[C@H](C(=O)OCc2ccccc2)[C@@H](O)[C@H]1O Homo sapiens CHEMBL857626 single protein format
CHEMBL4635734 OBDepict OH H H F H HO H N H HO N N N N H CH 3 IC50 = 370.0 nM 311.32 CNc1ncnc2c1ncn2[C@H]1[C@H](O)[C@H](O)[C@@H](CCO)[C@H]1F Homo sapiens CHEMBL4604199 assay format
CHEMBL3322533 OBDepict O N H N N O N O Cl CH 3 Cl IC50 = 380.0 nM 561.55 CN(C(=O)CN(CC(=O)NCCN1CCCC1)c1cc(Cl)ccc1Oc1ccc(Cl)cc1)C1CCCCC1 Homo sapiens CHEMBL3367518 single protein format
CHEMBL1098945 OBDepict OH OH N O N N N NH 2 IC50 = 400.0 nM 369.43 Nc1ncnc2c1ncn2Cc1cc(OCC2CCCCC2)cc(O)c1O Homo sapiens CHEMBL1114607 single protein format
CHEMBL595547 OBDepict NH 2 N N N N H O H OH H H HO O OH Ki = 410.0 nM 281.23 Nc1ncnc2c1ncn2[C@@H]1O[C@H](C(=O)O)[C@@H](O)[C@H]1O Homo sapiens CHEMBL857626 single protein format
CHEMBL154745 OBDepict H N H OH H HO N HO N NH 2 IC50 = 440.0 nM 262.27 Nc1nccc2c1ncn2[C@@H]1C=C(CO)[C@@H](O)[C@H]1O Homo sapiens CHEMBL3582891 assay format
CHEMBL3290668 OBDepict F H N H HO H OH N F N NH 2 IC50 = 455.0 nM 270.24 Nc1ncc(F)c2c1ncn2[C@@H]1C(F)C[C@@H](O)[C@H]1O Homo sapiens CHEMBL3294635 single protein format
CHEMBL64718 OBDepict HO F H HO H N H OH N N N NH 2 IC50 = 470.0 nM 281.25 Nc1ncnc2c1ncn2[C@@H]1C(F)=C(CO)[C@@H](O)[C@H]1O Homo sapiens CHEMBL803150 assay format
CHEMBL310547 OBDepict OH H HO H N H HO N N N NH 2 IC50 = 480.0 nM 277.28 Nc1ncnc2c1ncn2[C@@H]1C=C(CCO)[C@@H](O)[C@H]1O Homo sapiens CHEMBL3582891 assay format
CHEMBL295729 OBDepict OH H 3 C N N N N NH 2 Ki = 500.0 nM 219.25 C/C(=CCn1cnc2c(N)ncnc21)CO Homo sapiens CHEMBL800520 assay format
CHEMBL3322532 OBDepict O NH N N O N O Cl CH 3 Cl IC50 = 530.0 nM 569.53 CN(Cc1ccccc1)C(=O)CN(CC(=O)NCCN1CCCC1)c1cc(Cl)ccc1Oc1ccc(Cl)cc1 Homo sapiens CHEMBL3367518 single protein format
CHEMBL611098 OBDepict HC H O H HO N H HO N N N NH 2 Ki = 550.0 nM 287.28 C#C/C=C/[C@H]1OC(n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O Homo sapiens CHEMBL841783 single protein format
CHEMBL608072 OBDepict H 3 C N O H 3 C H O H HO N H OH N N N NH 2 Ki = 570.0 nM 336.35 CCN(CC)C(=O)[C@H]1OC(n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O Homo sapiens CHEMBL857626 single protein format
CHEMBL610383 OBDepict H 3 C CH 3 O O H O H OH N H HO N N N H 2 N Ki = 570.0 nM 337.34 CC(C)COC(=O)[C@H]1OC(n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O Homo sapiens CHEMBL857626 single protein format
CHEMBL296392 OBDepict CH 3 H H OH H N H HO N N N H 2 N Ki = 586.0 nM 263.3 CC[C@H]1C[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O Homo sapiens CHEMBL804129 assay format
CHEMBL3322560 OBDepict O HN N H N H O N O Cl CH 3 Cl IC50 = 600.0 nM 581.54 CN(C(=O)CN(CC(=O)NC[C@H]1CCCN1)c1cc(Cl)ccc1Oc1ccc(Cl)cc1)C1Cc2ccccc2C1 Homo sapiens CHEMBL3367518 single protein format
CHEMBL2364569 OBDepict OH N H O H HO H N H HO N N N NH 2 Ki = 670.0 nM 280.24 Nc1ncnc2c1ncn2[C@H]1O[C@@H](/C=N/O)[C@H](O)[C@@H]1O Homo sapiens CHEMBL828793 assay format
CHEMBL1288616 OBDepict OH N H O H HO H N H HO N N N NH 2 Ki = 670.0 nM 280.24 Nc1ncnc2c1ncn2[C@@H]1O[C@H](C=NO)[C@@H](O)[C@H]1O Homo sapiens CHEMBL801948 single protein format
CHEMBL3290661 OBDepict NH 2 N N N F H H OH H F H HO IC50 = 672.0 nM 270.24 Nc1ncc(F)c2c1ncn2[C@@H]1C[C@@H](F)[C@@H](O)[C@H]1O Homo sapiens CHEMBL3294636 cell-based format
CHEMBL604208 OBDepict CH H O H OH N H HO N N N H 2 N Ki = 681.0 nM 261.24 C#C[C@H]1OC(n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O Homo sapiens CHEMBL801946 assay format
CHEMBL610384 OBDepict CH 3 O O H O H OH N H HO N N N H 2 N Ki = 710.0 nM 337.34 CCCCOC(=O)[C@H]1OC(n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O Homo sapiens CHEMBL857626 single protein format
CHEMBL4538845 OBDepict CH 3 N H N N N N H F F H OH H H HO OH IC50 = 760.0 nM 315.28 CNc1ncnc2c1ncn2[C@H]1[C@H](O)[C@H](O)[C@@H](CO)C1(F)F Homo sapiens CHEMBL4361018 assay format
CHEMBL608915 OBDepict CH 3 O CH 3 O H O H OH N H HO N N N H 2 N Ki = 770.0 nM 323.31 CC(C)OC(=O)[C@H]1OC(n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O Homo sapiens CHEMBL857626 single protein format
CHEMBL2368540 OBDepict HO O H N H HO N N N NH 2 Ki = 800.0 nM 261.24 Nc1ncnc2c1ncn2[C@@H]1C=C(CO)C(=O)[C@H]1O Homo sapiens CHEMBL800519 single protein format
CHEMBL299961 OBDepict NH 2 N N N N H H OH H HO IC50 = 877.0 nM 233.23 Nc1ncnc2c1ncn2[C@@H]1C=C[C@@H](O)[C@H]1O Homo sapiens CHEMBL3294636 cell-based format
CHEMBL3290649 OBDepict NH 2 N N N F H H OH H HO H HO IC50 = 878.0 nM 268.25 Nc1ncc(F)c2c1ncn2[C@@H]1C[C@@H](O)[C@@H](O)[C@H]1O Homo sapiens CHEMBL3294636 cell-based format
CHEMBL8771 OBDepict HO H HO H N H HO N N N NH 2 IC50 = 890.0 nM 263.26 Nc1ncnc2c1ncn2[C@@H]1C=C(CO)[C@@H](O)[C@H]1O Homo sapiens CHEMBL803150 assay format
CHEMBL3580900 OBDepict HO F H HO H N H OH N N N NH 2 IC50 = 910.0 nM 295.27 Nc1ncnc2c1ncn2[C@@H]1C(F)=C(CCO)[C@@H](O)[C@H]1O Homo sapiens CHEMBL3582891 assay format
CHEMBL298115 OBDepict H 3 C CH 3 N N N N NH 2 IC50 = 930.0 nM 203.25 CC(C)=CCn1cnc2c(N)ncnc21 Homo sapiens CHEMBL798952 assay format
CHEMBL296107 OBDepict HO HO N N N N NH 2 IC50 = 950.0 nM 235.25 Nc1ncnc2c1ncn2C/C=C/C(O)CO Homo sapiens CHEMBL798952 assay format
CHEMBL3290667 OBDepict F H N H HO H OH N F N NH 2 IC50 = 976.0 nM 268.22 Nc1ncc(F)c2c1ncn2[C@@H]1C(F)=C[C@@H](O)[C@H]1O Homo sapiens CHEMBL3294635 single protein format
CHEMBL46348 OBDepict HO N N N N NH 2 IC50 = 1000.0 nM 203.21 Nc1ncnc2c1ncn2CC#CCO Homo sapiens CHEMBL798952 assay format