BDBM50332591 CHEMBL1630776::N-methyl-N-(2-pentylcyclohexyl)-7H-pyrrolo[2,3-d]pyrimidin-4-amine

SMILES: CCCCCC1CCCCC1N(C)c1ncnc2[nH]ccc12

InChI Key: InChIKey=RZSNEVHHIPCCOX-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50332591   

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 JAK3 (Homo sapiens (Human))	BDBM50332591 (CHEMBL1630776 | N-methyl-N-(2-pentylcyclohexyl)-7H...) Show SMILES CCCCCC1CCCCC1N(C)c1ncnc2[nH]ccc12 Show InChI InChI=1S/C18H28N4/c1-3-4-5-8-14-9-6-7-10-16(14)22(2)18-15-11-12-19-17(15)20-13-21-18/h11-14,16H,3-10H2,1-2H3,(H,19,20,21)	PDB 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	800	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of GST-tagged human JAK3 catalytic domain expressed in Sf9 cells by ELISA				J Med Chem 53: 8468-84 (2010) Article DOI: 10.1021/jm1004286 BindingDB Entry DOI: 10.7270/Q2154H9D
					More data for this Ligand-Target Pair