BDBM50332050 CHEMBL1288215::methyl 3-(2-(isoquinolin-5-yl)acetamido)thiophene-2-carboxylate

SMILES: COC(=O)c1sccc1NC(=O)Cc1cccc2cnccc12

InChI Key: InChIKey=JDCPDRSOEKCKGX-UHFFFAOYSA-N

Data: 5 IC50

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 5 hits for monomerid = 50332050   

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))	BDBM50332050 (CHEMBL1288215 | methyl 3-(2-(isoquinolin-5-yl)acet...) Show SMILES COC(=O)c1sccc1NC(=O)Cc1cccc2cnccc12 Show InChI InChI=1S/C17H14N2O3S/c1-22-17(21)16-14(6-8-23-16)19-15(20)9-11-3-2-4-12-10-18-7-5-13(11)12/h2-8,10H,9H2,1H3,(H,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
Elan Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of recombinant JNK1 after 60 mins by TR-FRET assay				Bioorg Med Chem Lett 20: 7303-7 (2010) Article DOI: 10.1016/j.bmcl.2010.10.066 BindingDB Entry DOI: 10.7270/Q20865JW
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 9 (Homo sapiens (Human))	BDBM50332050 (CHEMBL1288215 | methyl 3-(2-(isoquinolin-5-yl)acet...) Show SMILES COC(=O)c1sccc1NC(=O)Cc1cccc2cnccc12 Show InChI InChI=1S/C17H14N2O3S/c1-22-17(21)16-14(6-8-23-16)19-15(20)9-11-3-2-4-12-10-18-7-5-13(11)12/h2-8,10H,9H2,1H3,(H,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Elan Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of recombinant JNK2 after 60 mins by TR-FRET assay				Bioorg Med Chem Lett 20: 7303-7 (2010) Article DOI: 10.1016/j.bmcl.2010.10.066 BindingDB Entry DOI: 10.7270/Q20865JW
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 14 (Homo sapiens (Human))	BDBM50332050 (CHEMBL1288215 | methyl 3-(2-(isoquinolin-5-yl)acet...) Show SMILES COC(=O)c1sccc1NC(=O)Cc1cccc2cnccc12 Show InChI InChI=1S/C17H14N2O3S/c1-22-17(21)16-14(6-8-23-16)19-15(20)9-11-3-2-4-12-10-18-7-5-13(11)12/h2-8,10H,9H2,1H3,(H,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Elan Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of recombinant p38alpha after 60 mins by TR-FRET assay				Bioorg Med Chem Lett 20: 7303-7 (2010) Article DOI: 10.1016/j.bmcl.2010.10.066 BindingDB Entry DOI: 10.7270/Q20865JW
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 1 (Homo sapiens (Human))	BDBM50332050 (CHEMBL1288215 | methyl 3-(2-(isoquinolin-5-yl)acet...) Show SMILES COC(=O)c1sccc1NC(=O)Cc1cccc2cnccc12 Show InChI InChI=1S/C17H14N2O3S/c1-22-17(21)16-14(6-8-23-16)19-15(20)9-11-3-2-4-12-10-18-7-5-13(11)12/h2-8,10H,9H2,1H3,(H,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Elan Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of recombinant Erk2 after 60 mins by TR-FRET assay				Bioorg Med Chem Lett 20: 7303-7 (2010) Article DOI: 10.1016/j.bmcl.2010.10.066 BindingDB Entry DOI: 10.7270/Q20865JW
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase 10 (Homo sapiens (Human))	BDBM50332050 (CHEMBL1288215 | methyl 3-(2-(isoquinolin-5-yl)acet...) Show SMILES COC(=O)c1sccc1NC(=O)Cc1cccc2cnccc12 Show InChI InChI=1S/C17H14N2O3S/c1-22-17(21)16-14(6-8-23-16)19-15(20)9-11-3-2-4-12-10-18-7-5-13(11)12/h2-8,10H,9H2,1H3,(H,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	610	n/a	n/a	n/a	n/a	n/a	n/a
Elan Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of recombinant JNK3 after 60 mins by TR-FRET assay				Bioorg Med Chem Lett 20: 7303-7 (2010) Article DOI: 10.1016/j.bmcl.2010.10.066 BindingDB Entry DOI: 10.7270/Q20865JW
					More data for this Ligand-Target Pair