null

SMILES: O[C@H]1CC[C@H](CC1)Nc1nccc(n1)-n1ccc2c(cccc12)N1CCN(CC1)C(=O)CC#N

InChI Key: InChIKey=WMOAJNNZXGCJHX-KDURUIRLSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 102608   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Mitogen-activated protein kinase 8 (Homo sapiens (Human))	BDBM102608 (US8536172, I-57) Show SMILES O[C@H]1CC[C@H](CC1)Nc1nccc(n1)-n1ccc2c(cccc12)N1CCN(CC1)C(=O)CC#N |r,wU:4.7,1.0,(-7.55,-4,;-7.55,-2.46,;-8.89,-1.69,;-8.89,-.15,;-7.55,.62,;-6.22,-.15,;-6.22,-1.69,;-7.55,2.16,;-6.22,2.93,;-6.22,4.47,;-4.89,5.24,;-3.55,4.47,;-3.55,2.93,;-4.89,2.16,;-2.22,2.16,;-.76,2.64,;.15,1.39,;-.76,.14,;-.44,-1.36,;-1.58,-2.39,;-3.04,-1.92,;-3.36,-.41,;-2.22,.62,;1.05,-1.76,;1.45,-3.25,;2.94,-3.65,;4.03,-2.56,;3.63,-1.07,;2.14,-.67,;5.51,-2.96,;6.6,-1.87,;5.91,-4.44,;7.4,-4.84,;8.89,-5.24,)| Show InChI InChI=1S/C25H29N7O2/c26-11-8-24(34)31-16-14-30(15-17-31)21-2-1-3-22-20(21)10-13-32(22)23-9-12-27-25(29-23)28-18-4-6-19(33)7-5-18/h1-3,9-10,12-13,18-19,33H,4-8,14-17H2,(H,27,28,29)/t18-,19+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	88.4	n/a	n/a	n/a	n/a	7.5	n/a
Roche Palo Alto LLC US Patent					Assay Description JNK activity was measured by phosphorylation of GST-ATF2 (19-96) with [gamma-33P] ATP.				US Patent US8536172 (2013) BindingDB Entry DOI: 10.7270/Q23N222K
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 8 (Homo sapiens (Human))	BDBM102608 (US8536172, I-57) Show SMILES O[C@H]1CC[C@H](CC1)Nc1nccc(n1)-n1ccc2c(cccc12)N1CCN(CC1)C(=O)CC#N |r,wU:4.7,1.0,(-7.55,-4,;-7.55,-2.46,;-8.89,-1.69,;-8.89,-.15,;-7.55,.62,;-6.22,-.15,;-6.22,-1.69,;-7.55,2.16,;-6.22,2.93,;-6.22,4.47,;-4.89,5.24,;-3.55,4.47,;-3.55,2.93,;-4.89,2.16,;-2.22,2.16,;-.76,2.64,;.15,1.39,;-.76,.14,;-.44,-1.36,;-1.58,-2.39,;-3.04,-1.92,;-3.36,-.41,;-2.22,.62,;1.05,-1.76,;1.45,-3.25,;2.94,-3.65,;4.03,-2.56,;3.63,-1.07,;2.14,-.67,;5.51,-2.96,;6.6,-1.87,;5.91,-4.44,;7.4,-4.84,;8.89,-5.24,)| Show InChI InChI=1S/C25H29N7O2/c26-11-8-24(34)31-16-14-30(15-17-31)21-2-1-3-22-20(21)10-13-32(22)23-9-12-27-25(29-23)28-18-4-6-19(33)7-5-18/h1-3,9-10,12-13,18-19,33H,4-8,14-17H2,(H,27,28,29)/t18-,19+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	15.9	n/a	n/a	n/a	n/a	7.5	n/a
Roche Palo Alto LLC US Patent					Assay Description JNK activity was measured by phosphorylation of GST-ATF2 (19-96) with [gamma-33P] ATP.				US Patent US8536172 (2013) BindingDB Entry DOI: 10.7270/Q23N222K
					More data for this Ligand-Target Pair