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Q9Y2I1 | NISCH_HUMAN | Nischarin (NISCH)

3D structures mapped by conservation among orthologs

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[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL3546401 OBDepict H 3 C N N H Cl Ki = 0.22 nM 248.76 CC1CN=C(Nc2ccc(Cl)c3c2CCC3)C1 Homo sapiens CHEMBL3888188 assay format
CHEMBL3546402 OBDepict CH 3 N N H H 3 C Ki = 2.8 nM 228.34 Cc1ccc(NC2=NCC(C)C2)c2c1CCC2 Homo sapiens CHEMBL3888188 assay format
CHEMBL3546398 OBDepict CH 3 N N H Cl Ki = 2.8 nM 248.76 CC1CCC(Nc2ccc(Cl)c3c2CCC3)=N1 Homo sapiens CHEMBL3888188 assay format
CHEMBL360803 OBDepict Cl N I Cl N H HN Ki = 4.8 nM 355.99 Clc1cc(I)cc(Cl)c1N=C1NCCN1 Homo sapiens CHEMBL989166 assay format
CHEMBL762 OBDepict CH 3 CH 3 OH H 3 C H 3 C CH 3 N H N Ki = 6.2 nM 260.38 Cc1cc(C(C)(C)C)c(O)c(C)c1CC1=NCCN1 Homo sapiens CHEMBL989166 assay format
CHEMBL3547056 OBDepict CH 3 N H Cl N H 3 C Ki = 8.1 nM 222.72 Cc1c(Cl)cccc1NC1=NCC(C)C1 Homo sapiens CHEMBL3888188 assay format
CHEMBL134 OBDepict Cl N Cl N H HN Ki = 8.9 nM 230.1 Clc1cccc(Cl)c1N=C1NCCN1 Homo sapiens CHEMBL841852 single protein format
CHEMBL275970 OBDepict NH N Ki = 10.0 nM 172.23 C(=C/c1ccccc1)C1=NCCN1 Homo sapiens CHEMBL841026 assay format
CHEMBL597 OBDepict CH 3 N N H N HO Ki = 11.4 nM 281.36 Cc1ccc(N(CC2=NCCN2)c2cccc(O)c2)cc1 Homo sapiens CHEMBL989166 assay format
CHEMBL6310 OBDepict H 3 C O N H NH Ki = 12.0 nM 202.26 COc1ccc2c3c([nH]c2c1)CNCC3 Homo sapiens CHEMBL841867 single protein format
CHEMBL60186 OBDepict HN N O N Ki = 13.0 nM 227.27 c1cc2c3c(c1)ccn3CC(C1=NCCN1)O2 Homo sapiens CHEMBL874098 single protein format
CHEMBL14242 OBDepict F N O CH 3 NH N Ki = 17.0 nM 235.26 CN1CC(C2=NCCN2)Oc2ccc(F)cc21 Homo sapiens CHEMBL841871 single protein format
CHEMBL300388 OBDepict CH 3 O N O CH 3 N H N Ki = 17.0 nM 275.35 CCOCc1ccc2c(c1)N(C)CC(C1=NCCN1)O2 Homo sapiens CHEMBL841871 single protein format
CHEMBL3546379 OBDepict CH 3 N N H Ki = 19.0 nM 214.31 CC1CCC(Nc2cccc3c2CCC3)=N1 Homo sapiens CHEMBL3888188 assay format
CHEMBL13987 OBDepict CH 3 N O CH 3 N H N Ki = 21.7 nM 231.3 Cc1ccc2c(c1)N(C)CC(C1=NCCN1)O2 Homo sapiens CHEMBL874098 single protein format
CHEMBL269538 OBDepict H 3 C O N H CH 3 N Ki = 22.0 nM 212.25 COc1ccc2c(c1)[nH]c1c(C)nccc12 Homo sapiens CHEMBL841867 single protein format
CHEMBL13958 OBDepict CH 3 N O N H N CH 3 Ki = 22.7 nM 231.3 Cc1cccc2c1OC(C1=NCCN1)CN2C Homo sapiens CHEMBL874098 single protein format
CHEMBL1079 OBDepict Cl N H N N N H N S Ki = 28.3 nM 253.72 Clc1ccc2nsnc2c1NC1=NCCN1 Homo sapiens CHEMBL989166 assay format
CHEMBL420 OBDepict NH 2 N H NH N Cl Cl Ki = 34.7 nM 231.09 N=C(N)N/N=C/c1c(Cl)cccc1Cl Homo sapiens CHEMBL989166 assay format
CHEMBL146997 OBDepict CH 3 N O N N H NH NH 2 Ki = 37.0 nM 429.65 CCC(=O)N(CCCCCCCCNC(=N)N)C1CCN(CCc2ccccc2)CC1 Homo sapiens CHEMBL881221 single protein format
CHEMBL430112 OBDepict H 3 C CH 3 H 2 N Ki = 42.0 nM 153.27 CC(C)C1C2CCC(C2)C1N Homo sapiens CHEMBL841852 single protein format
CHEMBL60031 OBDepict CH 3 N O N H N CH 3 CH 3 Ki = 44.0 nM 245.33 Cc1cc2c(cc1C)N(C)CC(C1=NCCN1)O2 Homo sapiens CHEMBL874098 single protein format
CHEMBL295234 OBDepict CH 3 N N H Ki = 46.0 nM 184.24 CC1=NCCc2c1[nH]c1ccccc21 Homo sapiens CHEMBL841854 single protein format
CHEMBL13955 OBDepict NH N O N Ki = 48.0 nM 229.28 c1cc2c3c(c1)OC(C1=NCCN1)CN3CC2 Homo sapiens CHEMBL874098 single protein format
CHEMBL57895 OBDepict CH 3 O HN N Ki = 52.4 nM 216.28 CCC1(C2=NCCN2)Cc2ccccc2O1 Homo sapiens CHEMBL989166 assay format
CHEMBL14028 OBDepict CH 3 N O NH N Ki = 56.0 nM 217.27 CN1CC(C2=NCCN2)Oc2ccccc21 Homo sapiens CHEMBL874098 single protein format
CHEMBL19236 OBDepict CH 3 O N N H H 3 C N Cl N H N Ki = 56.0 nM 241.68 COc1nc(C)nc(Cl)c1NC1=NCCN1 Homo sapiens CHEMBL841852 single protein format
CHEMBL289480 OBDepict O N N H Ki = 59.2 nM 180.25 C1COC(NC(C2CC2)C2CC2)=N1 Homo sapiens CHEMBL989166 assay format
CHEMBL404505 OBDepict N H N O Ki = 70.0 nM 186.21 c1ccc2oc(C3=NCCN3)cc2c1 Homo sapiens CHEMBL841026 assay format
CHEMBL274315 OBDepict CH 3 O N O CH 3 N H N Ki = 78.6 nM 247.3 COc1ccc2c(c1)N(C)CC(C1=NCCN1)O2 Homo sapiens CHEMBL874098 single protein format
CHEMBL62107 OBDepict CH 3 O O N O CH 3 N H N Ki = 88.0 nM 275.31 COC(=O)c1ccc2c(c1)N(C)CC(C1=NCCN1)O2 Homo sapiens CHEMBL874098 single protein format
CHEMBL61689 OBDepict CH 3 N O NH N Ki = 93.0 nM 267.33 CN1CC(C2=NCCN2)Oc2cc3ccccc3cc21 Homo sapiens CHEMBL874098 single protein format
CHEMBL13852 OBDepict N H N O Ki = 99.0 nM 216.28 c1ccc(C2CC2)c(OCC2=NCCN2)c1 Homo sapiens CHEMBL989166 assay format
CHEMBL2058634 OBDepict CH 3 N N H Cl Ki = 120.0 nM 208.69 CC1CCC(Nc2ccccc2Cl)=N1 Homo sapiens CHEMBL3888188 assay format
CHEMBL761 OBDepict N H N Ki = 121.6 nM 210.28 c1ccc2c(CC3=NCCN3)cccc2c1 Homo sapiens CHEMBL989166 assay format
CHEMBL13810 OBDepict Cl N O CH 3 NH N Ki = 140.0 nM 251.72 CN1CC(C2=NCCN2)Oc2ccc(Cl)cc21 Homo sapiens CHEMBL874098 single protein format
CHEMBL274784 OBDepict HN N O N Ki = 150.0 nM 243.31 c1cc2c3c(c1)OC(C1=NCCN1)CN3CCC2 Homo sapiens CHEMBL874098 single protein format
CHEMBL269236 OBDepict H N NH Ki = 180.0 nM 172.23 c1ccc2c3c([nH]c2c1)CNCC3 Homo sapiens CHEMBL841026 assay format
CHEMBL58187 OBDepict HO N O CH 3 HN N Ki = 204.0 nM 247.3 CN1CC(C2=NCCN2)Oc2ccc(CO)cc21 Homo sapiens CHEMBL874098 single protein format
CHEMBL1162356 OBDepict Cl N N H HN N Ki = 232.0 nM 236.71 Clc1cccc2c1CN(NC1=NCCN1)C2 Homo sapiens CHEMBL989166 assay format
CHEMBL276035 OBDepict CH 3 O N CH 3 NH N Ki = 260.0 nM 231.3 Cc1ccc2c(c1)OC(C1=NCCN1)CN2C Homo sapiens CHEMBL874098 single protein format
CHEMBL10316 OBDepict N H N O O Ki = 300.0 nM 204.23 c1ccc2c(c1)OCC(C1=NCCN1)O2 Homo sapiens CHEMBL841853 single protein format
CHEMBL13940 OBDepict H 3 C N O NH N Ki = 450.0 nM 245.33 CCCN1CC(C2=NCCN2)Oc2ccccc21 Homo sapiens CHEMBL874098 single protein format
CHEMBL13858 OBDepict CH 3 O O N O N H N Ki = 560.0 nM 285.3 COc1cc(=O)n2c3c(cccc13)OC(C1=NCCN1)C2 Homo sapiens CHEMBL874098 single protein format
CHEMBL13591 OBDepict CH 3 N O NH N Ki = 621.0 nM 267.33 CN1CC(C2=NCCN2)Oc2c1ccc1ccccc21 Homo sapiens CHEMBL841871 single protein format
CHEMBL418716 OBDepict N O N H N Ki = 643.0 nM 257.34 c1cc2c3c(c1)OC(C1=NCCN1)CN3CCCC2 Homo sapiens CHEMBL841871 single protein format
CHEMBL267074 OBDepict CH 3 N O NH N Ki = 690.0 nM 271.36 CN1CC(C2=NCCN2)Oc2cc3c(cc21)CCCC3 Homo sapiens CHEMBL874098 single protein format
CHEMBL14110 OBDepict CH 3 N O CH 3 N H N Ki = 760.0 nM 231.3 Cc1cccc2c1N(C)CC(C1=NCCN1)O2 Homo sapiens CHEMBL874098 single protein format
CHEMBL13918 OBDepict N H N O N H Ki = 840.0 nM 203.25 c1ccc2c(c1)NCC(C1=NCCN1)O2 Homo sapiens CHEMBL874098 single protein format