BDBM50261216 CHEMBL4082575

SMILES: Clc1cccc(Cl)c1-c1ccc2cnc(NC(=O)C3CC3)cc2c1

InChI Key: InChIKey=CVRVCFVDHZISJV-UHFFFAOYSA-N

Data: 2 KI

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 = 50261216   

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 JAK2 (Homo sapiens (Human))	BDBM50261216 (CHEMBL4082575) Show SMILES Clc1cccc(Cl)c1-c1ccc2cnc(NC(=O)C3CC3)cc2c1 Show InChI InChI=1S/C19H14Cl2N2O/c20-15-2-1-3-16(21)18(15)12-6-7-13-10-22-17(9-14(13)8-12)23-19(24)11-4-5-11/h1-3,6-11H,4-5H2,(H,22,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	16	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Genentech Curated by ChEMBL					Assay Description Inhibition of JAK2 (unknown origin) by biochemical assay				Bioorg Med Chem Lett 27: 4370-4376 (2017) Article DOI: 10.1016/j.bmcl.2017.08.022 BindingDB Entry DOI: 10.7270/Q2RF5XG8
					More data for this Ligand-Target Pair
Non-receptor tyrosine-protein kinase TYK2 (Homo sapiens (Human))	BDBM50261216 (CHEMBL4082575) Show SMILES Clc1cccc(Cl)c1-c1ccc2cnc(NC(=O)C3CC3)cc2c1 Show InChI InChI=1S/C19H14Cl2N2O/c20-15-2-1-3-16(21)18(15)12-6-7-13-10-22-17(9-14(13)8-12)23-19(24)11-4-5-11/h1-3,6-11H,4-5H2,(H,22,23,24)	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	42	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Genentech Curated by ChEMBL					Assay Description Inhibition of TYK2 (unknown origin) assessed as reduction in IL-23 induced STAT3 phosphorylation by cell based ELISA				Bioorg Med Chem Lett 27: 4370-4376 (2017) Article DOI: 10.1016/j.bmcl.2017.08.022 BindingDB Entry DOI: 10.7270/Q2RF5XG8
					More data for this Ligand-Target Pair