HOME LIGAND hPROTEOME OTHERS DOCUMENT

P49137 | MAPK2_HUMAN | MAP kinase-activated protein kinase 2 (MAPKAPK2)

3D structures mapped by conservation among orthologs

[ Domain: "Protein kinase" // Pkinase_Tyr ]

download pymol session

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

download pymol session



[ 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
CHEMBL4855730 OBDepict F NH S N O O H 2 N O HN IC50 = -65200.0 nM 452.51 Nc1ncc(-c2ccc(NS(=O)(=O)C3CC3)cc2F)cc1-c1ccc2c(c1)CCNC2=O Homo sapiens CHEMBL4804423 cell-based format
CHEMBL4868141 OBDepict H 2 N N O O HN NH S O O IC50 = -52200.0 nM 532.67 Nc1ncc(-c2ccc(NS(=O)(=O)C3CC3)cc2OC2CCCCC2)cc1-c1ccc2c(c1)CCNC2=O Homo sapiens CHEMBL4804423 cell-based format
CHEMBL4867931 OBDepict H 3 C O N H S N O O H 2 N O HN IC50 = -34300.0 nM 464.55 COc1cc(NS(=O)(=O)C2CC2)ccc1-c1cnc(N)c(-c2ccc3c(c2)CCNC3=O)c1 Homo sapiens CHEMBL4804423 cell-based format
CHEMBL4860979 OBDepict F S N O O CH 3 N H 2 N O N H IC50 = -5000.0 nM 466.54 CN(C1CC1)S(=O)(=O)c1ccc(-c2cnc(N)c(-c3ccc4c(c3)CCNC4=O)c2)c(F)c1 Homo sapiens CHEMBL4804423 cell-based format
CHEMBL561334 OBDepict O NH S H CH 3 HN N IC50 = 1.0 nM 283.36 C[C@@H]1CNc2c(sc3ccc4ncccc4c23)C(=O)N1 Homo sapiens CHEMBL1061558 single protein format
CHEMBL1801384 OBDepict O N H N H N N O IC50 = 1.0 nM 438.53 O=C1NCCc2[nH]c3c(ccc4cnc(/C=C/c5ccc(CN6CCOCC6)cc5)cc43)c21 Homo sapiens CHEMBL1805901 single protein format
CHEMBL2385548 OBDepict N O O N N N N N H IC50 = 1.9 nM 552.64 N#Cc1ccc(-c2cc3c(o2)C(=O)N(Cc2ccccc2-c2cncnc2)c2ccc(N4CCNCC4)cc2C3)cc1 Homo sapiens CHEMBL2389966 single protein format
CHEMBL403154 OBDepict O N H N S N H N O CH 3 CH 3 H 3 C N H 3 C CH 3 O HN IC50 = 2.0 nM 536.7 CC(C)(C)CN1CCC(NC(=O)c2csc(NC(=O)c3ccc4cc5n(c4c3)C(C)(C)CNC5=O)n2)CC1 Homo sapiens CHEMBL949020 single protein format
CHEMBL257834 OBDepict O NH N S N H N O H 3 C CH 3 H 3 C N O NH IC50 = 2.0 nM 548.71 CC(C)(C)CN1CCC(NC(=O)c2csc(NC(=O)c3ccc4cc5n(c4c3)C3(CCC3)CNC5=O)n2)CC1 Homo sapiens CHEMBL949020 single protein format
CHEMBL556392 OBDepict Cl N S HN O NH H CH 3 IC50 = 2.0 nM 317.8 C[C@@H]1CNc2c(sc3ccc4nc(Cl)ccc4c23)C(=O)N1 Homo sapiens CHEMBL1061558 single protein format
CHEMBL258045 OBDepict H 3 C N NH O N S NH O N O NH IC50 = 2.0 nM 492.61 CN1CCC(NC(=O)c2csc(NC(=O)c3ccc4cc5n(c4c3)C3(CCC3)CNC5=O)n2)CC1 Homo sapiens CHEMBL949020 single protein format
CHEMBL1938685 OBDepict N O N N N HN IC50 = 2.9 nM 407.48 N#Cc1ccc(-c2cc3c(o2)-c2nccn2-c2ccc(N4CCNCC4)cc2C3)cc1 Homo sapiens CHEMBL1942718 single protein format
CHEMBL1801306 OBDepict CH 3 O N N N H O NH N H 3 C IC50 < 3.0 nM 401.47 COc1ccc(-c2ncc3c(n2)-c2[nH]c4c(c2CC3)C(=O)NCC42CN(C)C2)cc1 Homo sapiens CHEMBL1805885 single protein format
CHEMBL256194 OBDepict O NH N S N H N O H 3 C CH 3 H 3 C N CH 3 NH O IC50 = 3.0 nM 522.68 CC1CNC(=O)c2cc3ccc(C(=O)Nc4nc(C(=O)NC5CCN(CC(C)(C)C)CC5)cs4)cc3n21 Homo sapiens CHEMBL949020 single protein format
CHEMBL403258 OBDepict O NH N S N H N O N O NH IC50 = 3.0 nM 568.7 O=C(Nc1nc(C(=O)NC2CCN(Cc3ccccc3)CC2)cs1)c1ccc2cc3n(c2c1)C1(CCC1)CNC3=O Homo sapiens CHEMBL949020 single protein format
CHEMBL2385549 OBDepict N O O N N N N H IC50 = 3.0 nM 551.65 N#Cc1ccc(-c2cc3c(o2)C(=O)N(Cc2ccccc2-c2cncnc2)c2ccc(C4CCNCC4)cc2C3)cc1 Homo sapiens CHEMBL2389966 single protein format
CHEMBL1801308 OBDepict H 3 C N NH N H O N N O N O IC50 < 3.0 nM 500.6 CN1CC2(CNC(=O)c3c2[nH]c2c3CCc3cnc(-c4ccc(OCCN5CCOCC5)cc4)nc3-2)C1 Homo sapiens CHEMBL1805885 single protein format
CHEMBL1801290 OBDepict H 3 C N NH N H O N O N O IC50 < 3.0 nM 499.62 CN1CC2(CNC(=O)c3c2[nH]c2c3CCc3cnc(-c4ccc(OCCN5CCOCC5)cc4)cc3-2)C1 Homo sapiens CHEMBL1805885 single protein format
CHEMBL1801291 OBDepict H 3 C N NH N H O N F IC50 < 3.0 nM 402.47 CCN1CC2(CNC(=O)c3c2[nH]c2c3CCc3cnc(-c4ccccc4F)cc3-2)C1 Homo sapiens CHEMBL1805885 single protein format
CHEMBL1801289 OBDepict H 3 C N NH N H O N N F IC50 < 3.0 nM 389.43 CN1CC2(CNC(=O)c3c2[nH]c2c3CCc3cnc(-c4ccc(F)nc4)cc3-2)C1 Homo sapiens CHEMBL1805885 single protein format
CHEMBL1801286 OBDepict H 3 C O O N N N H O NH N H 3 C IC50 < 3.0 nM 459.55 COCCCOc1cncc(-c2cc3c(cn2)CCc2c-3[nH]c3c2C(=O)NCC32CN(C)C2)c1 Homo sapiens CHEMBL1805885 single protein format
CHEMBL1938687 OBDepict N O N N N N HN IC50 = 3.8 nM 408.47 N#Cc1ccc(-c2cc3c(o2)-c2nncn2-c2ccc(N4CCNCC4)cc2C3)cc1 Homo sapiens CHEMBL1942718 single protein format
CHEMBL255991 OBDepict H 3 C CH 3 N N H O N S N H O N H 3 C N H O IC50 = 4.0 nM 508.65 CC(C)CN1CCC(NC(=O)c2csc(NC(=O)c3ccc4cc5n(c4c3)C(C)CNC5=O)n2)CC1 Homo sapiens CHEMBL949020 single protein format
CHEMBL1801296 OBDepict H 3 C N NH N H O N F IC50 = 4.0 nM 416.5 CN1CCC2(CC1)CNC(=O)c1c2[nH]c2c1CCc1cnc(-c3ccccc3F)cc1-2 Homo sapiens CHEMBL1805885 single protein format
CHEMBL1089865 OBDepict H 3 C O N N H O H 3 C N N F F IC50 = 4.3 nM 434.45 Cc1ccc(C(=O)NC2CC2)cc1-c1cc2cnn(-c3c(F)cccc3F)c2n(C)c1=O Homo sapiens CHEMBL1104503 single protein format
CHEMBL2385542 OBDepict CH 3 O N N O O N N H N IC50 = 4.9 nM 581.68 COc1cncc(-c2ccccc2CN2C(=O)c3oc(-c4ccc(C#N)cc4)cc3Cc3cc(N4CCNCC4)ccc32)c1 Homo sapiens CHEMBL2389966 single protein format
CHEMBL1231206 OBDepict H 3 C N N S HN O NH H CH 3 Ki = 5.0 nM 374.47 Cc1ccc(-c2ccc3c(ccc4sc5c(c43)NC[C@@H](C)NC5=O)n2)cn1 Homo sapiens CHEMBL3877222 single protein format
CHEMBL1801381 OBDepict O N H N H N N O N O IC50 = 5.0 nM 429.48 O=C1NCc2[nH]c3c(ccc4cnc(-c5cncc(OCCN6CCOCC6)c5)cc43)c21 Homo sapiens CHEMBL1805901 single protein format
CHEMBL270148 OBDepict H 3 C N N H O N S HN O N H 3 C H 3 C O NH IC50 = 5.0 nM 480.59 CN1CCC(NC(=O)c2csc(NC(=O)c3ccc4cc5n(c4c3)C(C)(C)CNC5=O)n2)CC1 Homo sapiens CHEMBL949020 single protein format
CHEMBL1801385 OBDepict O NH N H N N O IC50 = 5.0 nM 452.56 O=C1NCCc2[nH]c3c(ccc4cnc(/C=C/c5cccc(CCN6CCOCC6)c5)cc43)c21 Homo sapiens CHEMBL1805901 single protein format
CHEMBL1231206 OBDepict H 3 C N N S HN O NH H CH 3 IC50 = 5.0 nM 374.47 Cc1ccc(-c2ccc3c(ccc4sc5c(c43)NC[C@@H](C)NC5=O)n2)cn1 Homo sapiens CHEMBL2166136 single protein format
CHEMBL560075 OBDepict O NH S H CH 3 HN N N IC50 = 5.0 nM 360.44 C[C@@H]1CNc2c(sc3ccc4nc(-c5cccnc5)ccc4c23)C(=O)N1 Homo sapiens CHEMBL1061558 single protein format
CHEMBL429504 OBDepict O NH N S N H N O N CH 3 CH 3 O N H IC50 = 5.0 nM 556.69 CC1(C)CNC(=O)c2cc3ccc(C(=O)Nc4nc(C(=O)NC5CCN(Cc6ccccc6)CC5)cs4)cc3n21 Homo sapiens CHEMBL949020 single protein format
CHEMBL549915 OBDepict O NH S H CH 3 HN N N CH 3 IC50 = 5.0 nM 374.47 Cc1ccncc1-c1ccc2c(ccc3sc4c(c32)NC[C@@H](C)NC4=O)n1 Homo sapiens CHEMBL1061558 single protein format
CHEMBL1801382 OBDepict H 3 C O O N N N H NH O IC50 = 5.0 nM 374.4 COCCOc1cncc(-c2cc3c(ccc4c5c([nH]c43)CNC5=O)cn2)c1 Homo sapiens CHEMBL1805901 single protein format
CHEMBL555205 OBDepict H HN H 2 N NH O S O CH 3 IC50 = 5.0 nM 277.35 COc1ccc2sc3c(c2c1)NC[C@@H](CN)NC3=O Homo sapiens CHEMBL1063344 single protein format
CHEMBL271309 OBDepict CH 3 N NH O N S N H O N CH 3 HN O IC50 = 5.0 nM 466.57 CC1CNC(=O)c2cc3ccc(C(=O)Nc4nc(C(=O)NC5CCN(C)CC5)cs4)cc3n21 Homo sapiens CHEMBL949020 single protein format
CHEMBL1091199 OBDepict F F N N N CH 3 O H 3 C N H O IC50 = 5.7 nM 434.45 Cc1ccc(C(=O)NC2CC2)cc1-c1cc2cnn(-c3ccc(F)cc3F)c2n(C)c1=O Homo sapiens CHEMBL1104503 single protein format
CHEMBL2385547 OBDepict Cl O O N N N N N H IC50 = 5.7 nM 562.07 O=C1c2oc(-c3ccc(Cl)cc3)cc2Cc2cc(N3CCNCC3)ccc2N1Cc1ccccc1-c1cncnc1 Homo sapiens CHEMBL2389966 single protein format
CHEMBL1801305 OBDepict H 3 C N NH N H O N N F IC50 = 6.0 nM 389.43 CN1CC2(CNC(=O)c3c2[nH]c2c3CCc3cnc(-c4cccc(F)c4)nc3-2)C1 Homo sapiens CHEMBL1805885 single protein format
CHEMBL1801304 OBDepict H 3 C O O N N N N H O NH N H 3 C IC50 = 6.0 nM 446.51 COCCOc1cncc(-c2ncc3c(n2)-c2[nH]c4c(c2CC3)C(=O)NCC42CN(C)C2)c1 Homo sapiens CHEMBL1805885 single protein format
CHEMBL3902121 OBDepict F F O Cl CH 3 N O CH 3 N N N OH H 3 C H 3 C IC50 = 6.4 nM 512.94 Cc1cnc(-c2ccnc(C(C)(C)O)n2)cc1-n1c(C)cc(OCc2ccc(F)cc2F)c(Cl)c1=O Homo sapiens CHEMBL3888628 assay format
CHEMBL1092754 OBDepict OH N H O N N CH 3 O O OH IC50 = 6.5 nM 455.47 Cn1cc(/C=C2Oc3cccc(O)c3C2=O)c2c(-c3ccc(C(=O)NCCO)cc3)ccnc21 Homo sapiens CHEMBL1107913 single protein format
CHEMBL2385546 OBDepict N O O N N N O NH H 3 C IC50 = 6.8 nM 581.68 COc1ccncc1-c1ccccc1CN1C(=O)c2oc(-c3ccc(C#N)cc3)cc2Cc2cc(N3CCNCC3)ccc21 Homo sapiens CHEMBL2389966 single protein format
CHEMBL1801307 OBDepict H 3 C N NH N H O N N N F IC50 = 7.0 nM 390.42 CN1CC2(CNC(=O)c3c2[nH]c2c3CCc3cnc(-c4ccc(F)nc4)nc3-2)C1 Homo sapiens CHEMBL1805885 single protein format
CHEMBL256196 OBDepict H 3 C N N H O N S N H O N CH 3 N H O IC50 = 7.0 nM 480.59 CCN1CCC(NC(=O)c2csc(NC(=O)c3ccc4cc5n(c4c3)C(C)CNC5=O)n2)CC1 Homo sapiens CHEMBL949020 single protein format
CHEMBL1938684 OBDepict Cl O N N N HN IC50 = 7.0 nM 416.91 Clc1ccc(-c2cc3c(o2)-c2nccn2-c2ccc(N4CCNCC4)cc2C3)cc1 Homo sapiens CHEMBL1942718 single protein format
CHEMBL1091928 OBDepict Cl O N HN O H 3 C N N F F IC50 = 7.0 nM 454.86 Cn1c(=O)c(-c2cc(C(=O)NC3CC3)ccc2Cl)cc2cnn(-c3c(F)cccc3F)c21 Homo sapiens CHEMBL1104503 single protein format
CHEMBL3314153 OBDepict N O N N Cl N HN IC50 = 7.7 nM 429.91 N#Cc1ccc(-c2ccc(-c3nccn3-c3ccc(N4CCNCC4)c(Cl)c3)o2)cc1 Homo sapiens CHEMBL3369592 single protein format
CHEMBL388530 OBDepict O N H N N H O N H IC50 = 8.0 nM 422.49 O=C(NCc1ccccc1)c1ccc(-c2cc(-c3cc4c([nH]3)CCNC4=O)ccn2)cc1 Homo sapiens CHEMBL904788 single protein format
CHEMBL1940645 OBDepict N O N O N N H N IC50 = 8.0 nM 563.66 N#Cc1ccc(-c2ccc(C(=O)N(Cc3ccccc3-c3ccc(C#N)cc3)c3ccc(N4CCNCC4)cc3)o2)cc1 Homo sapiens CHEMBL1943215 single protein format
CHEMBL1940652 OBDepict N O N O N N O CH 3 NH IC50 = 8.0 nM 569.66 COc1ccncc1-c1ccccc1CN(C(=O)c1ccc(-c2ccc(C#N)cc2)o1)c1ccc(N2CCNCC2)cc1 Homo sapiens CHEMBL1943215 single protein format
CHEMBL1801374 OBDepict O NH N H N N O IC50 = 8.0 nM 424.5 O=C1NCc2[nH]c3c(ccc4cnc(/C=C/c5ccc(CN6CCOCC6)cc5)cc43)c21 Homo sapiens CHEMBL1805901 single protein format
CHEMBL388853 OBDepict O NH N N H O N H IC50 = 8.0 nM 400.48 O=C(NC1CCCC1)c1ccc(-c2cc(-c3cc4c([nH]3)CCNC4=O)ccn2)cc1 Homo sapiens CHEMBL904788 single protein format
CHEMBL1801274 OBDepict F N N H O HN IC50 = 8.0 nM 333.37 O=C1NCCc2[nH]c3c(c21)CCc1cnc(-c2cccc(F)c2)cc1-3 Homo sapiens CHEMBL1805885 single protein format
CHEMBL2036616 OBDepict N O N N O N N N NH IC50 = 8.0 nM 553.63 N#Cc1ccc(-c2ccc(C3=NOC(c4ccccc4-c4cncnc4)N3c3ccc(N4CCNCC4)cc3)o2)cc1 Homo sapiens CHEMBL2040538 single protein format
CHEMBL2385545 OBDepict N O O N N O N NH H 3 C IC50 = 8.4 nM 581.68 COc1ncccc1-c1ccccc1CN1C(=O)c2oc(-c3ccc(C#N)cc3)cc2Cc2cc(N3CCNCC3)ccc21 Homo sapiens CHEMBL2389966 single protein format
CHEMBL226403 OBDepict O N H N H N N IC50 = 8.5 nM 340.39 O=C1NCCc2[nH]c(-c3ccnc(-c4cnc5ccccc5c4)c3)cc21 Homo sapiens CHEMBL904788 single protein format
CHEMBL2385550 OBDepict N O O N F F N N N H IC50 = 8.9 nM 587.63 N#Cc1ccc(-c2cc3c(o2)C(=O)N(Cc2ccccc2-c2cncnc2)c2ccc(C4CCNCC4)cc2C3(F)F)cc1 Homo sapiens CHEMBL2389966 single protein format
CHEMBL1940648 OBDepict N O N O N N N H IC50 = 9.0 nM 539.64 N#Cc1ccc(-c2ccc(C(=O)N(Cc3ccccc3-c3cccnc3)c3ccc(N4CCNCC4)cc3)o2)cc1 Homo sapiens CHEMBL1943215 single protein format
CHEMBL403286 OBDepict O NH N S N H N O N CH 3 N H O IC50 = 9.0 nM 542.67 CC1CNC(=O)c2cc3ccc(C(=O)Nc4nc(C(=O)NC5CCN(Cc6ccccc6)CC5)cs4)cc3n21 Homo sapiens CHEMBL949020 single protein format
CHEMBL564076 OBDepict O NH S H CH 3 HN N IC50 = 9.0 nM 359.45 C[C@@H]1CNc2c(sc3ccc4nc(-c5ccccc5)ccc4c23)C(=O)N1 Homo sapiens CHEMBL1061558 single protein format
CHEMBL1940658 OBDepict CH 3 O N N N O O N NH N IC50 = 9.0 nM 570.65 COc1ccncc1-c1ncccc1CN(C(=O)c1ccc(-c2ccc(C#N)cc2)o1)c1ccc(N2CCNCC2)cc1 Homo sapiens CHEMBL1943215 single protein format
CHEMBL1940518 OBDepict N O N O N N H IC50 = 9.0 nM 538.65 N#Cc1ccc(-c2ccc(C(=O)N(Cc3ccccc3-c3ccccc3)c3ccc(N4CCNCC4)cc3)o2)cc1 Homo sapiens CHEMBL1943215 single protein format
CHEMBL1938689 OBDepict Cl O N N H 3 C N HN IC50 = 9.2 nM 430.94 Cc1cnc2n1-c1ccc(N3CCNCC3)cc1Cc1cc(-c3ccc(Cl)cc3)oc1-2 Homo sapiens CHEMBL1942718 single protein format
CHEMBL1938686 OBDepict Cl O N N N N HN IC50 = 9.3 nM 417.9 Clc1ccc(-c2cc3c(o2)-c2nncn2-c2ccc(N4CCNCC4)cc2C3)cc1 Homo sapiens CHEMBL1942718 single protein format
CHEMBL1801375 OBDepict O NH N H N N O IC50 = 10.0 nM 438.53 O=C1NCc2[nH]c3c(ccc4cnc(/C=C/c5cccc(CCN6CCOCC6)c5)cc43)c21 Homo sapiens CHEMBL1805901 single protein format
CHEMBL1801388 OBDepict O NH N H N N O N O IC50 = 10.0 nM 443.51 O=C1NCCc2[nH]c3c(ccc4cnc(-c5cncc(OCCN6CCOCC6)c5)cc43)c21 Homo sapiens CHEMBL1805901 single protein format
CHEMBL1801373 OBDepict O NH N H N IC50 = 10.0 nM 325.37 O=C1NCc2[nH]c3c(ccc4cnc(/C=C/c5ccccc5)cc43)c21 Homo sapiens CHEMBL1805901 single protein format
CHEMBL1614995 OBDepict CH 3 O O N N N H O HN IC50 = 10.0 nM 388.43 COCCOc1cncc(-c2cc3c(ccc4c5c([nH]c43)CCNC5=O)cn2)c1 Homo sapiens CHEMBL1805885 single protein format
CHEMBL246301 OBDepict CH 3 N NH O N S N H O N H CH 3 HN O IC50 = 10.0 nM 466.57 CC1CNC(=O)c2[nH]c3ccc(C(=O)Nc4nc(C(=O)NC5CCN(C)CC5)cs4)cc3c21 Homo sapiens CHEMBL923957 single protein format
CHEMBL1940657 OBDepict CH 3 O N N O O N NH N IC50 = 12.0 nM 569.67 COc1ccccc1-c1ncccc1CN(C(=O)c1ccc(-c2ccc(C#N)cc2)o1)c1ccc(N2CCNCC2)cc1 Homo sapiens CHEMBL1943215 single protein format
CHEMBL1940647 OBDepict H 3 C O N O O N NH N IC50 = 12.0 nM 568.68 COc1cccc(-c2ccccc2CN(C(=O)c2ccc(-c3ccc(C#N)cc3)o2)c2ccc(N3CCNCC3)cc2)c1 Homo sapiens CHEMBL1943215 single protein format
CHEMBL272072 OBDepict O NH S N N CH 3 N H O NH O O IC50 = 12.0 nM 453.52 CC1CNC(=O)c2cc3ccc(C(=O)Nc4nc(C(=O)NC5CCOCC5)cs4)cc3n21 Homo sapiens CHEMBL949020 single protein format
CHEMBL2385532 OBDepict H 2 C N O O N HN Cl IC50 = 12.0 nM 433.94 C=CCN1C(=O)c2oc(-c3ccc(Cl)cc3)cc2Cc2cc(N3CCNCC3)ccc21 Homo sapiens CHEMBL2389966 single protein format
CHEMBL1940521 OBDepict N O N O N F N H IC50 = 12.0 nM 556.64 N#Cc1ccc(-c2ccc(C(=O)N(Cc3ccccc3-c3ccccc3F)c3ccc(N4CCNCC4)cc3)o2)cc1 Homo sapiens CHEMBL1943215 single protein format
CHEMBL1940524 OBDepict N O N O N N N H IC50 = 12.0 nM 539.64 N#Cc1ccc(-c2ccc(C(=O)N(Cc3ccccc3-c3ccncc3)c3ccc(N4CCNCC4)cc3)o2)cc1 Homo sapiens CHEMBL1943215 single protein format
CHEMBL1801294 OBDepict CH 3 O N N H O NH NH IC50 = 12.0 nM 386.46 COc1ccc(-c2cc3c(cn2)CCc2c-3[nH]c3c2C(=O)NC2(CNC2)C3)cc1 Homo sapiens CHEMBL1805885 single protein format
CHEMBL1801312 OBDepict H 3 C N NH N H 3 C O N F IC50 = 13.0 nM 402.47 CN1CC2(CNC(=O)c3c4c(n(C)c32)-c2cc(-c3ccccc3F)ncc2CC4)C1 Homo sapiens CHEMBL1805885 single protein format
CHEMBL3314148 OBDepict N O N N Cl N HN IC50 = 13.0 nM 429.91 N#Cc1ccc(-c2ccc(-c3nccn3-c3ccc(N4CCNCC4)cc3Cl)o2)cc1 Homo sapiens CHEMBL3369592 single protein format
CHEMBL1801313 OBDepict H 2 N N H O OH N IC50 = 14.0 nM 343.39 NCc1[nH]c2c(ccc3cnc(/C=C/c4ccccc4)cc32)c1C(=O)O Homo sapiens CHEMBL1805901 single protein format
CHEMBL553397 OBDepict H HN HO NH O S O CH 3 IC50 = 14.0 nM 278.33 COc1ccc2sc3c(c2c1)NC[C@@H](CO)NC3=O Homo sapiens CHEMBL1063344 single protein format
CHEMBL554286 OBDepict O NH S H CH 3 HN N F IC50 = 14.0 nM 377.44 C[C@@H]1CNc2c(sc3ccc4nc(-c5ccccc5F)ccc4c23)C(=O)N1 Homo sapiens CHEMBL1061558 single protein format
CHEMBL1940649 OBDepict N O N O N N N H IC50 = 14.0 nM 539.64 N#Cc1ccc(-c2ccc(C(=O)N(Cc3ccccc3-c3ccccn3)c3ccc(N4CCNCC4)cc3)o2)cc1 Homo sapiens CHEMBL1943215 single protein format
CHEMBL552339 OBDepict O NH S H CH 3 HN N N IC50 = 14.0 nM 360.44 C[C@@H]1CNc2c(sc3ccc4nc(-c5ccncc5)ccc4c23)C(=O)N1 Homo sapiens CHEMBL1061558 single protein format
CHEMBL2385537 OBDepict Cl O O N H HN IC50 = 14.0 nM 392.89 O=C1Nc2ccc(C3CCNCC3)cc2Cc2cc(-c3ccc(Cl)cc3)oc21 Homo sapiens CHEMBL2389966 single protein format
CHEMBL2385540 OBDepict N O O N N N N H F IC50 = 14.0 nM 569.64 N#Cc1ccc(-c2cc3c(o2)C(=O)N(Cc2ccccc2-c2cncc(F)c2)c2ccc(N4CCNCC4)cc2C3)cc1 Homo sapiens CHEMBL2389966 single protein format
CHEMBL3314142 OBDepict Cl O N N N N HN IC50 = 14.3 nM 405.89 Clc1ccc(-c2ccc(-c3nncn3-c3ccc(N4CCNCC4)cc3)o2)cc1 Homo sapiens CHEMBL3369592 single protein format
CHEMBL1938688 OBDepict F O N N N N HN IC50 = 15.0 nM 401.45 Fc1ccc(-c2cc3c(o2)-c2nncn2-c2ccc(N4CCNCC4)cc2C3)cc1 Homo sapiens CHEMBL1942718 single protein format
CHEMBL1783712 OBDepict S NH N H N O NH 2 N N H O IC50 = 15.0 nM 356.41 Nc1ncc(C2CC2)nc1CNC(=S)Nc1ccc2[nH]c(=O)oc2c1 Homo sapiens CHEMBL1786602 single protein format
CHEMBL226206 OBDepict O NH N N H O N H IC50 = 15.0 nM 372.43 O=C(NC1CC1)c1ccc(-c2cc(-c3cc4c([nH]3)CCNC4=O)ccn2)cc1 Homo sapiens CHEMBL904788 single protein format
CHEMBL1801386 OBDepict CH 3 O F N N H O NH IC50 = 15.0 nM 361.38 COc1ccc(-c2cc3c(ccc4c5c([nH]c43)CCNC5=O)cn2)cc1F Homo sapiens CHEMBL1805901 single protein format
CHEMBL557318 OBDepict O NH S H CH 3 HN O IC50 = 16.0 nM 272.33 C[C@@H]1CNc2c(sc3ccc4occc4c23)C(=O)N1 Homo sapiens CHEMBL1061558 single protein format
CHEMBL1801387 OBDepict O NH N H N O N O IC50 = 16.0 nM 442.52 O=C1NCCc2[nH]c3c(ccc4cnc(-c5cccc(OCCN6CCOCC6)c5)cc43)c21 Homo sapiens CHEMBL1805901 single protein format
CHEMBL3314147 OBDepict N O N N F N HN IC50 = 16.2 nM 413.46 N#Cc1ccc(-c2ccc(-c3nccn3-c3ccc(N4CCNCC4)cc3F)o2)cc1 Homo sapiens CHEMBL3369592 single protein format
CHEMBL1801284 OBDepict O HN N H NH N F IC50 = 17.0 nM 374.42 O=C1NCC2(CNC2)c2[nH]c3c(c21)CCc1cnc(-c2ccccc2F)cc1-3 Homo sapiens CHEMBL1805885 single protein format
CHEMBL396160 OBDepict H 2 N N H O N S NH O N H CH 3 N H O IC50 = 17.0 nM 412.48 CC1CNC(=O)c2[nH]c3ccc(C(=O)Nc4nc(C(=O)NCCN)cs4)cc3c21 Homo sapiens CHEMBL923957 single protein format
CHEMBL226261 OBDepict O N H N N H O N H IC50 = 17.0 nM 414.51 O=C(NC1CCCCC1)c1ccc(-c2cc(-c3cc4c([nH]3)CCNC4=O)ccn2)cc1 Homo sapiens CHEMBL904788 single protein format
CHEMBL3314149 OBDepict N O N N CH 3 N HN IC50 = 17.4 nM 409.49 Cc1cc(N2CCNCC2)ccc1-n1ccnc1-c1ccc(-c2ccc(C#N)cc2)o1 Homo sapiens CHEMBL3369592 single protein format
CHEMBL3962170 OBDepict F F O Cl CH 3 N O CH 3 N N N H 3 C H 3 C CH 3 IC50 = 18.0 nM 510.97 Cc1cnc(-c2ccnc(C(C)(C)C)n2)cc1-n1c(C)cc(OCc2ccc(F)cc2F)c(Cl)c1=O Homo sapiens CHEMBL3888628 assay format