BDBM50111685 CHEMBL3605102

SMILES: Cn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(Oc2ccccc2)cc1

InChI Key: InChIKey=CLNLVLABGKSUTI-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 = 50111685   

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
Tyrosine-protein kinase BTK (Homo sapiens (Human))	BDBM50111685 (CHEMBL3605102) Show SMILES Cn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C23H18N4OS/c1-27-13-16(11-26-27)19-12-25-23(24)21-20(14-29-22(19)21)15-7-9-18(10-8-15)28-17-5-3-2-4-6-17/h2-14H,1H3,(H2,24,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	107	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of human recombinant BTK incubated for 5 mins by HTRF kinase assay				Bioorg Med Chem 23: 6059-68 (2015) BindingDB Entry DOI: 10.7270/Q2445P7J
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK2 (Homo sapiens (Human))	BDBM50111685 (CHEMBL3605102) Show SMILES Cn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C23H18N4OS/c1-27-13-16(11-26-27)19-12-25-23(24)21-20(14-29-22(19)21)15-7-9-18(10-8-15)28-17-5-3-2-4-6-17/h2-14H,1H3,(H2,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of JAK2 (unknown origin) using poly (Glu-Tyr, 4:1) substrate incubated for 60 mins by ELISA method				Bioorg Med Chem 23: 6059-68 (2015) BindingDB Entry DOI: 10.7270/Q2445P7J
					More data for this Ligand-Target Pair
Tyrosine-protein kinase JAK3 (Homo sapiens (Human))	BDBM50111685 (CHEMBL3605102) Show SMILES Cn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C23H18N4OS/c1-27-13-16(11-26-27)19-12-25-23(24)21-20(14-29-22(19)21)15-7-9-18(10-8-15)28-17-5-3-2-4-6-17/h2-14H,1H3,(H2,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of JAK3 (unknown origin) using poly (Glu-Tyr, 4:1) substrate incubated for 60 mins by ELISA method				Bioorg Med Chem 23: 6059-68 (2015) BindingDB Entry DOI: 10.7270/Q2445P7J
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50111685 (CHEMBL3605102) Show SMILES Cn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C23H18N4OS/c1-27-13-16(11-26-27)19-12-25-23(24)21-20(14-29-22(19)21)15-7-9-18(10-8-15)28-17-5-3-2-4-6-17/h2-14H,1H3,(H2,24,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	343	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of KDR (unknown origin) using poly (Glu-Tyr, 4:1) substrate incubated for 60 mins by ELISA method				Bioorg Med Chem 23: 6059-68 (2015) BindingDB Entry DOI: 10.7270/Q2445P7J
					More data for this Ligand-Target Pair
Hepatocyte growth factor receptor (Homo sapiens (Human))	BDBM50111685 (CHEMBL3605102) Show SMILES Cn1cc(cn1)-c1cnc(N)c2c(csc12)-c1ccc(Oc2ccccc2)cc1 Show InChI InChI=1S/C23H18N4OS/c1-27-13-16(11-26-27)19-12-25-23(24)21-20(14-29-22(19)21)15-7-9-18(10-8-15)28-17-5-3-2-4-6-17/h2-14H,1H3,(H2,24,25)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of c-MET (unknown origin) using poly (Glu-Tyr, 4:1) substrate incubated for 60 mins by ELISA method				Bioorg Med Chem 23: 6059-68 (2015) BindingDB Entry DOI: 10.7270/Q2445P7J
					More data for this Ligand-Target Pair