BDBM50430453 CHEMBL2334713

SMILES: Oc1ccc2n(c(nc2c1)-c1ccc2ccccc2c1)-c1ccnc(NC2CCOCC2)c1

InChI Key: InChIKey=KVGMNWJSHWIYDZ-UHFFFAOYSA-N

Data: 2 Kd

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50430453   

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 10 (Homo sapiens (Human))	BDBM50430453 (CHEMBL2334713) Show SMILES Oc1ccc2n(c(nc2c1)-c1ccc2ccccc2c1)-c1ccnc(NC2CCOCC2)c1 Show InChI InChI=1S/C27H24N4O2/c32-23-7-8-25-24(17-23)30-27(20-6-5-18-3-1-2-4-19(18)15-20)31(25)22-9-12-28-26(16-22)29-21-10-13-33-14-11-21/h1-9,12,15-17,21,32H,10-11,13-14H2,(H,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a
Hanyang University Curated by ChEMBL					Assay Description Binding affinity to N-terminal His6X-tagged human recombinant JNK3 catalytic domain expressed in Escherichia coli BL21 (DE3) by surface plasmon reson...				Bioorg Med Chem 21: 2271-85 (2013) Article DOI: 10.1016/j.bmc.2013.02.021 BindingDB Entry DOI: 10.7270/Q29W0GVC
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 10 (Homo sapiens (Human))	BDBM50430453 (CHEMBL2334713) Show SMILES Oc1ccc2n(c(nc2c1)-c1ccc2ccccc2c1)-c1ccnc(NC2CCOCC2)c1 Show InChI InChI=1S/C27H24N4O2/c32-23-7-8-25-24(17-23)30-27(20-6-5-18-3-1-2-4-19(18)15-20)31(25)22-9-12-28-26(16-22)29-21-10-13-33-14-11-21/h1-9,12,15-17,21,32H,10-11,13-14H2,(H,28,29)	PDB MMDB NCI pathway Reactome pathway KEGG B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a
Hanyang University Curated by ChEMBL					Assay Description Binding affinity to JNK3 (unknown origin) by surface plasmon resonance analysis in presence of ATP				Bioorg Med Chem Lett 23: 1639-42 (2013) Article DOI: 10.1016/j.bmcl.2013.01.082 BindingDB Entry DOI: 10.7270/Q2F76DXD
					More data for this Ligand-Target Pair