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Q9Y463 | DYR1B_HUMAN | Dual specificity tyrosine-phosphorylation-regulated kinase 1B (DYRK1B)

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
CHEMBL4797548 OBDepict F N N N N N H O IC50 = 0.002 nM 339.37 Fc1ccccc1-n1cc(-c2ccnc(NC3CCOCC3)n2)cn1 Homo sapiens CHEMBL4742614 single protein format
CHEMBL4785938 OBDepict CH 3 HN N N N N F IC50 = 0.003 nM 283.31 CCNc1nccc(-c2cnn(-c3ccccc3F)c2)n1 Homo sapiens CHEMBL4742614 single protein format
CHEMBL4794264 OBDepict CH 3 O N N N N N H H 3 C N CH 3 N H IC50 = 0.003 nM 375.44 COc1ccccc1-n1cc(-c2ccnc(NCc3c(C)n[nH]c3C)n2)cn1 Homo sapiens CHEMBL4742614 single protein format
CHEMBL4787263 OBDepict F N N N N N H N IC50 = 0.004 nM 346.37 Fc1ccccc1-n1cc(-c2ccnc(NCc3ccncc3)n2)cn1 Homo sapiens CHEMBL4742614 single protein format
CHEMBL2386744 OBDepict CH 3 O HN N S N N H N F Br IC50 = 0.24 nM 432.28 COC(=N)c1nc2ccc3ncnc(Nc4ccc(Br)cc4F)c3c2s1 Homo sapiens CHEMBL2388920 single protein format
CHEMBL2386747 OBDepict CH 3 O HN N S N N H N Cl Cl IC50 = 0.28 nM 404.28 COC(=N)c1nc2ccc3ncnc(Nc4ccc(Cl)cc4Cl)c3c2s1 Homo sapiens CHEMBL2388920 single protein format
CHEMBL3894571 OBDepict CH 3 O F N H N N S N O NH CH 3 IC50 = 0.59 nM 383.41 COC(=N)c1nc2ccc3ncnc(Nc4ccc(OC)cc4F)c3c2s1 Homo sapiens CHEMBL3889023 single protein format
CHEMBL2386745 OBDepict H 3 C O NH N S N N H N O H 3 C F IC50 = 0.59 nM 383.41 COC(=N)c1nc2ccc3ncnc(Nc4ccc(F)cc4OC)c3c2s1 Homo sapiens CHEMBL2388920 single protein format
CHEMBL388978 OBDepict CH 3 HN H H O H O N H 3 C H 3 C N O N H IC50 = 0.967 nM 466.54 CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 Homo sapiens CHEMBL4328391 single protein format
CHEMBL3421963 OBDepict CH 3 O N H N N N N H 3 C N H N IC50 = 1.0 nM 415.5 COc1cc(N2CCN(C)CC2)ccc1Nc1cc(-c2c[nH]c3cnccc23)ncn1 Homo sapiens CHEMBL3424978 single protein format
CHEMBL2386748 OBDepict CH 3 O HN N S N N H N F F IC50 = 1.07 nM 371.37 COC(=N)c1nc2ccc3ncnc(Nc4ccc(F)cc4F)c3c2s1 Homo sapiens CHEMBL2388920 single protein format
CHEMBL3971170 OBDepict CH 3 O HN N S N N H N F Cl IC50 = 1.63 nM 387.83 COC(=N)c1nc2ccc3ncnc(Nc4ccc(Cl)cc4F)c3c2s1 Homo sapiens CHEMBL3889023 single protein format
CHEMBL2386746 OBDepict CH 3 O HN N S N N H N Cl F IC50 = 1.63 nM 387.83 COC(=N)c1nc2ccc3ncnc(Nc4ccc(F)cc4Cl)c3c2s1 Homo sapiens CHEMBL2388920 single protein format
CHEMBL3421962 OBDepict CH 3 N N N H N N N H N IC50 = 2.0 nM 385.48 CN1CCN(c2ccc(Nc3cc(-c4c[nH]c5cnccc45)ncn3)cc2)CC1 Homo sapiens CHEMBL3424978 single protein format
CHEMBL4872233 OBDepict CH 3 O N N H N HN O H 2 N IC50 = 2.0 nM 359.39 COc1ccc(-c2n[nH]c3ncc(-c4ccc(NC(N)=O)cc4)cc23)cc1 Homo sapiens CHEMBL4823188 single protein format
CHEMBL2386764 OBDepict CH 3 O HN N S N N H N CH 3 IC50 = 2.83 nM 349.42 COC(=N)c1nc2ccc3ncnc(Nc4ccc(C)cc4)c3c2s1 Homo sapiens CHEMBL2388920 single protein format
CHEMBL3421968 OBDepict CH 3 O N H N N N N H 3 C N CH 3 N IC50 = 3.0 nM 429.53 COc1cc(N2CCN(C)CC2)ccc1Nc1nccc(-c2cn(C)c3cnccc23)n1 Homo sapiens CHEMBL3424978 single protein format
CHEMBL4873449 OBDepict OH N N H N OH HO IC50 = 3.0 nM 319.32 Oc1ccc(-c2n[nH]c3ncc(-c4ccc(O)c(O)c4)cc23)cc1 Homo sapiens CHEMBL4823188 single protein format
CHEMBL2386763 OBDepict H 3 C O NH N S N N H N IC50 = 3.48 nM 335.39 COC(=N)c1nc2ccc3ncnc(Nc4ccccc4)c3c2s1 Homo sapiens CHEMBL2388920 single protein format
CHEMBL3915647 OBDepict H 3 C O NH S N N N H N Br O O IC50 = 3.66 nM 458.3 COC(=N)c1nc2ccc3ncnc(Nc4cc(Br)c5c(c4)OCO5)c3c2s1 Homo sapiens CHEMBL3889023 single protein format
CHEMBL3421967 OBDepict CH 3 O N H N N N N H 3 C N H N IC50 = 4.0 nM 415.5 COc1cc(N2CCN(C)CC2)ccc1Nc1nccc(-c2c[nH]c3cnccc23)n1 Homo sapiens CHEMBL3424978 single protein format
CHEMBL3421969 OBDepict CH 3 O N H N N N N H 3 C N H H 3 C N IC50 = 4.0 nM 429.53 COc1cc(N2CCN(C)CC2)ccc1Nc1nccc(-c2c[nH]c3cnc(C)cc23)n1 Homo sapiens CHEMBL3424978 single protein format
CHEMBL2386753 OBDepict H 3 C O NH N S N N H N O O IC50 = 4.2 nM 379.4 COC(=N)c1nc2ccc3ncnc(Nc4ccc5c(c4)OCO5)c3c2s1 Homo sapiens CHEMBL2388920 single protein format
CHEMBL3983413 OBDepict H 3 C O NH N S N N H N N N H IC50 = 4.65 nM 375.42 COC(=N)c1nc2ccc3ncnc(Nc4ccc5nc[nH]c5c4)c3c2s1 Homo sapiens CHEMBL3889023 single protein format
CHEMBL2386762 OBDepict CH 3 O HN N S N N H N Cl IC50 = 4.74 nM 369.84 COC(=N)c1nc2ccc3ncnc(Nc4ccc(Cl)cc4)c3c2s1 Homo sapiens CHEMBL2388920 single protein format
CHEMBL3421970 OBDepict CH 3 O N H N N N N H 3 C N H N CH 3 IC50 = 5.0 nM 429.53 COc1cc(N2CCN(C)CC2)ccc1Nc1nccc(-c2c[nH]c3c(C)nccc23)n1 Homo sapiens CHEMBL3424978 single protein format
CHEMBL4874485 OBDepict HO N N H N N H S O O CH 3 IC50 = 5.0 nM 380.43 CS(=O)(=O)Nc1ccc(-c2cnc3[nH]nc(-c4ccc(O)cc4)c3c2)cc1 Homo sapiens CHEMBL4823188 single protein format
CHEMBL2386749 OBDepict H 3 C O NH N S N N H N + N HO O _ O IC50 = 5.68 nM 396.39 COC(=N)c1nc2ccc3ncnc(Nc4ccc(O)c([N+](=O)[O-])c4)c3c2s1 Homo sapiens CHEMBL2388920 single protein format
CHEMBL4856089 OBDepict OH N N N H HO IC50 = 6.0 nM 303.32 Oc1ccc(-c2cnc3[nH]nc(-c4ccc(O)cc4)c3c2)cc1 Homo sapiens CHEMBL4823188 single protein format
CHEMBL1230165 OBDepict Cl N H N N O HO IC50 = 6.4 nM 349.78 O=C(O)c1ccc2c(c1)nc(Nc1cccc(Cl)c1)c1ccncc12 Homo sapiens CHEMBL4266683 single protein format
CHEMBL2386770 OBDepict CH 3 O HN N S N N H N Br F IC50 = 6.55 nM 432.28 COC(=N)c1nc2ccc3ncnc(Nc4ccc(F)cc4Br)c3c2s1 Homo sapiens CHEMBL2388920 single protein format
CHEMBL2392364 OBDepict Cl Cl NH N N O O IC50 = 7.0 nM 374.23 Clc1cc(Cl)cc(CNc2nccc(-c3ccc4c(c3)OCO4)n2)c1 Homo sapiens CHEMBL2394341 single protein format
CHEMBL4872136 OBDepict CH 3 O N N H N HN O H 3 C IC50 = 7.0 nM 358.4 COc1ccc(-c2n[nH]c3ncc(-c4ccc(NC(C)=O)cc4)cc23)cc1 Homo sapiens CHEMBL4823188 single protein format
CHEMBL2386766 OBDepict CH 3 O HN N S N N H N N IC50 = 7.69 nM 360.4 COC(=N)c1nc2ccc3ncnc(Nc4ccc(C#N)cc4)c3c2s1 Homo sapiens CHEMBL2388920 single protein format
CHEMBL2386760 OBDepict CH 3 O O N S N N H N Cl Cl IC50 = 7.7 nM 405.27 COC(=O)c1nc2ccc3ncnc(Nc4ccc(Cl)cc4Cl)c3c2s1 Homo sapiens CHEMBL2388920 single protein format
CHEMBL2386754 OBDepict CH 3 O NH N S N N H N O O IC50 = 7.72 nM 393.43 CCOC(=N)c1nc2ccc3ncnc(Nc4ccc5c(c4)OCO5)c3c2s1 Homo sapiens CHEMBL2388920 single protein format
CHEMBL3094437 OBDepict H 2 N HN O N H Cl O O N H N N N O IC50 = 8.0 nM 588.07 NCCC(NC(=O)c1ccc(Cl)c(NC(=O)c2cc3cnc(N4CC5CCC(C4)O5)nc3[nH]c2=O)c1)c1ccccc1 Homo sapiens CHEMBL3097669 single protein format
CHEMBL4294976 OBDepict CH 3 O N H N CH 3 N N H N NH 2 IC50 = 8.0 nM 374.45 CCOc1ccccc1CNc1nc(C)nc2[nH]cc(-c3ccnc(N)c3)c12 Homo sapiens CHEMBL4266680 assay format
CHEMBL3421971 OBDepict CH 3 O N H N N N N H 3 C N CH 3 N CH 3 IC50 = 9.0 nM 443.56 COc1cc(N2CCN(C)CC2)ccc1Nc1nccc(-c2cn(C)c3c(C)nccc23)n1 Homo sapiens CHEMBL3424978 single protein format
CHEMBL3421966 OBDepict CH 3 O N H N N N N O H 3 C N H N IC50 = 9.0 nM 443.51 COc1cc(N2CCN(C(C)=O)CC2)ccc1Nc1nccc(-c2c[nH]c3cnccc23)n1 Homo sapiens CHEMBL3424978 single protein format
CHEMBL3094454 OBDepict NH 2 N H O NH Cl O O N H N N O CH 3 IC50 = 9.0 nM 492.92 COc1ncc2cc(C(=O)Nc3cc(C(=O)NC(CN)c4ccccc4)ccc3Cl)c(=O)[nH]c2n1 Homo sapiens CHEMBL3097669 single protein format
CHEMBL2386765 OBDepict CH 3 O HN N S N N H N F IC50 = 9.64 nM 353.38 COC(=N)c1nc2ccc3ncnc(Nc4ccc(F)cc4)c3c2s1 Homo sapiens CHEMBL2388920 single protein format
CHEMBL4780461 OBDepict H 3 C N H O N N H N N + N O _ O H NH 2 ClH IC50 = 10.0 nM 481.94 CNC(=O)c1cnc2[nH]cc(-c3ccc4ncc([N+](=O)[O-])c(N5CCC[C@H](N)C5)c4c3)c2c1.Cl Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4796415 OBDepict N N HN N CH 3 N H N IC50 = 10.0 nM 382.47 CN1CCC(Nc2c(C#N)cnc3ccc(-c4c[nH]c5ncccc45)cc23)CC1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4872950 OBDepict NH 2 NH O N N N H HO IC50 = 10.0 nM 345.36 NC(=O)Nc1ccc(-c2cnc3[nH]nc(-c4ccc(O)cc4)c3c2)cc1 Homo sapiens CHEMBL4823188 single protein format
CHEMBL4789266 OBDepict Cl N N H N ClH IC50 < 10.0 nM 316.19 Cl.Clc1cc(-c2c[nH]c3ncccc23)cc2cccnc12 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4779484 OBDepict F N N H N IC50 < 10.0 nM 263.28 Fc1cc(-c2c[nH]c3ncccc23)cc2cccnc12 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4787359 OBDepict H N N N HN O IC50 < 10.0 nM 340.39 c1cnc2[nH]cc(-c3ccc4ncc(NCc5ccoc5)cc4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4784263 OBDepict F N N H N N IC50 < 10.0 nM 340.36 Fc1cc(-c2c[nH]c3ncccc23)cc2c(-c3cccnc3)ccnc12 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4790515 OBDepict H N N N IC50 < 10.0 nM 245.28 c1cnc2ccc(-c3c[nH]c4ncccc34)cc2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4788075 OBDepict CH 3 N H O N N H N N IC50 < 10.0 nM 379.42 CNC(=O)c1cnc2[nH]cc(-c3ccc4nccc(-c5cccnc5)c4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4785301 OBDepict H N N N IC50 < 10.0 nM 321.38 c1ccc(-c2ccnc3ccc(-c4c[nH]c5ncccc45)cc23)cc1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4799177 OBDepict O N H N N N H N HN + N H O _ O H H 2 N ClH IC50 = 10.0 nM 573.06 Cl.N[C@H]1CC[C@H](Nc2c([N+](=O)[O-])cnc3ccc(-c4c[nH]c5ncc(C(=O)NCc6cccnc6)cc45)cc23)CC1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4795459 OBDepict H N N N Cl IC50 = 10.0 nM 279.73 Clc1ccnc2ccc(-c3c[nH]c4ncccc34)cc12 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4790751 OBDepict H 3 C N H O N N H N N NH H H 2 N Cl ClH IC50 = 10.0 nM 576.53 CNC(=O)c1cnc2[nH]cc(-c3ccc4ncc(NCc5cccc(Cl)c5)c(N5CCC[C@H](N)C5)c4c3)c2c1.Cl Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4794147 OBDepict CH 3 N HN N N H N IC50 = 10.0 nM 357.46 CN1CCC(Nc2ccnc3ccc(-c4c[nH]c5ncccc45)cc23)CC1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4785328 OBDepict H 3 C N N H N N IC50 = 10.0 nM 336.4 Cc1cc(-c2c[nH]c3ncccc23)cc2c(-c3cccnc3)ccnc12 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4784584 OBDepict CH 3 N N H 3 C + N N O _ O N H N IC50 = 10.0 nM 416.49 CN1CCC(N(C)c2c([N+](=O)[O-])cnc3ccc(-c4c[nH]c5ncccc45)cc23)CC1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4780313 OBDepict H 2 C N N H N N CH 3 CH 2 IC50 = 10.0 nM 396.54 C=CCCCc1ccnc2ccc(-c3c[nH]c4ncc(CN(C)CC=C)cc34)cc12 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4780293 OBDepict CH 3 N H O N N H N N O IC50 < 10.0 nM 387.44 CNC(=O)c1cnc2[nH]cc(-c3ccc4nccc(N5CCOCC5)c4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4788999 OBDepict CH 2 N CH 3 O N N H Cl N IC50 = 10.0 nM 376.85 C=CCN(C)C(=O)c1cnc2[nH]cc(-c3cc(Cl)c4ncccc4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4796652 OBDepict O HN N N H Cl N IC50 = 10.0 nM 412.88 O=C(NCc1ccccc1)c1cnc2[nH]cc(-c3cc(Cl)c4ncccc4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4797371 OBDepict O NH N N H F N N IC50 = 10.0 nM 473.51 O=C(NCc1ccccc1)c1cnc2[nH]cc(-c3cc(F)c4nccc(-c5cccnc5)c4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4782343 OBDepict CH 3 N H O N N H N N HN O Cl IC50 = 10.0 nM 527.03 CNC(=O)c1cnc2[nH]cc(-c3ccc4ncc(NCc5cccc(Cl)c5)c(N5CCOCC5)c4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4780889 OBDepict CH 2 N CH 3 O N N H F N N IC50 = 10.0 nM 437.48 C=CCN(C)C(=O)c1cnc2[nH]cc(-c3cc(F)c4nccc(-c5cccnc5)c4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4782648 OBDepict CH 2 N CH 3 N N H F N N IC50 = 10.0 nM 423.5 C=CCN(C)Cc1cnc2[nH]cc(-c3cc(F)c4nccc(-c5cccnc5)c4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4785163 OBDepict CH 3 N H O N N H N N HN O O IC50 = 10.0 nM 500.6 CNC(=O)c1cnc2[nH]cc(-c3ccc4ncc(NCC5CCOCC5)c(N5CCOCC5)c4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4798594 OBDepict CH 2 N CH 3 O N N H N Cl IC50 = 10.0 nM 376.85 C=CCN(C)C(=O)c1cnc2[nH]cc(-c3ccc4nccc(Cl)c4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4798819 OBDepict CH 2 N HO H N N H N IC50 < 10.0 nM 410.52 C=CC1CN2CCC1CC2[C@H](O)c1ccnc2ccc(-c3c[nH]c4ncccc34)cc12 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4795553 OBDepict H N N F N H N N IC50 < 10.0 nM 459.53 Fc1cc(-c2c[nH]c3ncc(CNCc4ccccc4)cc23)cc2c(-c3cccnc3)ccnc12 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4784703 OBDepict CH 3 N H O N N H F N N CH 3 IC50 < 10.0 nM 411.44 CNC(=O)c1cnc2[nH]cc(-c3cc(F)c4nccc(-c5cnccc5C)c4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4794271 OBDepict H 3 C N H O N N H F N N IC50 < 10.0 nM 397.41 CC(=O)Nc1cnc2[nH]cc(-c3cc(F)c4nccc(-c5cccnc5)c4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4786159 OBDepict H 2 N N H O N N H Cl N ClH IC50 < 10.0 nM 416.31 Cl.NCCCNC(=O)c1cnc2[nH]cc(-c3cc(Cl)c4ncccc4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4791911 OBDepict O NH N N N H F N N IC50 < 10.0 nM 474.5 O=C(NCc1cccnc1)c1cnc2[nH]cc(-c3cc(F)c4nccc(-c5cccnc5)c4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4778365 OBDepict NH 2 O N N H F N IC50 < 10.0 nM 306.3 NC(=O)c1cnc2[nH]cc(-c3cc(F)c4ncccc4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4783465 OBDepict O N H N N N H F N N H NH 2 ClH IC50 < 10.0 nM 532.02 Cl.N[C@@H]1CCCN(c2ccnc3c(F)cc(-c4c[nH]c5ncc(C(=O)NCc6cccnc6)cc45)cc23)C1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4796725 OBDepict H 3 C N H O N N H F N N H NH 2 ClH IC50 < 10.0 nM 454.94 CNC(=O)c1cnc2[nH]cc(-c3cc(F)c4nccc(N5CCC[C@@H](N)C5)c4c3)c2c1.Cl Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4787211 OBDepict O HN N N H F N IC50 < 10.0 nM 396.43 O=C(NCc1ccccc1)c1cnc2[nH]cc(-c3cc(F)c4ncccc4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4777524 OBDepict NH 2 N H O N N H F N N ClH IC50 < 10.0 nM 476.94 Cl.NCCCNC(=O)c1cnc2[nH]cc(-c3cc(F)c4nccc(-c5cccnc5)c4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4782545 OBDepict CH 3 N H O N N H F N IC50 < 10.0 nM 320.33 CNC(=O)c1cnc2[nH]cc(-c3cc(F)c4ncccc4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4798464 OBDepict CH 3 N H O N N H F N N IC50 < 10.0 nM 397.41 CNC(=O)c1cnc2[nH]cc(-c3cc(F)c4nccc(-c5cccnc5)c4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4779923 OBDepict H N N N N H H 2 N IC50 < 10.0 nM 343.43 N[C@H]1CCCN(c2ccnc3ccc(-c4c[nH]c5ncccc45)cc23)C1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4792646 OBDepict O N H N N N N H F N N H NH 2 ClH IC50 < 10.0 nM 533.01 Cl.N[C@@H]1CCCN(c2ccnc3c(F)cc(-c4c[nH]c5ncc(C(=O)NCc6cncnc6)cc45)cc23)C1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4780486 OBDepict H N N N N H NH 2 IC50 < 10.0 nM 329.41 N[C@H]1CCN(c2ccnc3ccc(-c4c[nH]c5ncccc45)cc23)C1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4795920 OBDepict H 3 C N H O N N H F N N H NH 2 ClH IC50 < 10.0 nM 454.94 CNC(=O)c1cnc2[nH]cc(-c3cc(F)c4nccc(N5CCC[C@H](N)C5)c4c3)c2c1.Cl Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4777649 OBDepict H 2 N N H O N N H F N ClH IC50 < 10.0 nM 399.86 Cl.NCCCNC(=O)c1cnc2[nH]cc(-c3cc(F)c4ncccc4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4792018 OBDepict CH 3 N H O N N H N IC50 < 10.0 nM 302.34 CNC(=O)c1cnc2[nH]cc(-c3ccc4ncccc4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4778932 OBDepict H N N F N H N N H NH 2 IC50 < 10.0 nM 480.59 N[C@@H]1CCCN(c2ccnc3c(F)cc(-c4c[nH]c5ncc(CNCc6ccccc6)cc45)cc23)C1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4795783 OBDepict CH 3 N H O N N H N Cl IC50 < 10.0 nM 336.78 CNC(=O)c1cnc2[nH]cc(-c3ccc4nccc(Cl)c4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4776181 OBDepict H 3 C N H O N N H N N NH 2 H NH 2 ClH IC50 < 10.0 nM 451.96 CNC(=O)c1cnc2[nH]cc(-c3ccc4ncc(N)c(N5CCC[C@H](N)C5)c4c3)c2c1.Cl Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4795260 OBDepict CH 3 N H O N N H N N NH O O CH 3 IC50 < 10.0 nM 444.5 CNC(=O)c1cnc2[nH]cc(-c3ccc4ncc(NC(C)=O)c(N5CCOCC5)c4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4788717 OBDepict H N N N N IC50 < 10.0 nM 322.37 c1cncc(-c2ccnc3ccc(-c4c[nH]c5ncccc45)cc23)c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4788819 OBDepict NH 2 N N H N NH O N IC50 < 10.0 nM 394.44 Nc1cnc2ccc(-c3c[nH]c4ncc(C(=O)NCc5cccnc5)cc34)cc2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4795136 OBDepict CH 3 N H O N N H N N H O N IC50 < 10.0 nM 436.48 CC(=O)Nc1cnc2ccc(-c3c[nH]c4ncc(C(=O)NCc5cccnc5)cc34)cc2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4784265 OBDepict O N H N N N H N HN O IC50 < 10.0 nM 492.58 O=C(NCc1cccnc1)c1cnc2[nH]cc(-c3ccc4ncc(NCC5CCOCC5)cc4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4782142 OBDepict H 3 C NH O N N H F N IC50 < 10.0 nM 424.48 CNC(=O)c1cnc2[nH]cc(-c3cc(F)c4nccc(CCc5ccccc5)c4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4799100 OBDepict CH 3 N O HN NH 2 N N H N IC50 < 10.0 nM 400.49 CC(=O)N1CCC(Nc2c(N)cnc3ccc(-c4c[nH]c5ncccc45)cc23)CC1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4798075 OBDepict H N N N N IC50 < 10.0 nM 322.37 c1cnc2[nH]cc(-c3ccc4nccc(-c5ccncc5)c4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL4778726 OBDepict CH 2 N CH 3 O N N H F N IC50 < 10.0 nM 360.39 C=CCN(C)C(=O)c1cnc2[nH]cc(-c3cc(F)c4ncccc4c3)c2c1 Homo sapiens CHEMBL4742493 cell-based format
CHEMBL3094462 OBDepict NH 2 N H O Cl N H Cl O O N H N N O CH 3 IC50 = 11.0 nM 541.4 COc1ncc2cc(C(=O)Nc3cc(C(=O)NC(CCN)c4cccc(Cl)c4)ccc3Cl)c(=O)[nH]c2n1 Homo sapiens CHEMBL3097669 single protein format