BDBM50315942 (S)-N-(2-(1-phenylethylamino)pyrimidin-4-yl)-N-((tetrahydro-2H-pyran-4-yl)methyl)-2,3-dihydrobenzofuran-5-carboxamide::CHEMBL1090588

SMILES: C[C@H](Nc1nccc(n1)N(CC1CCOCC1)C(=O)c1ccc2OCCc2c1)c1ccccc1

InChI Key: InChIKey=IBAMRTUVIGLWGW-IBGZPJMESA-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 = 50315942   

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 14 (Homo sapiens (Human))	BDBM50315942 ((S)-N-(2-(1-phenylethylamino)pyrimidin-4-yl)-N-((t...) Show SMILES C[C@H](Nc1nccc(n1)N(CC1CCOCC1)C(=O)c1ccc2OCCc2c1)c1ccccc1 |r| Show InChI InChI=1S/C27H30N4O3/c1-19(21-5-3-2-4-6-21)29-27-28-13-9-25(30-27)31(18-20-10-14-33-15-11-20)26(32)23-7-8-24-22(17-23)12-16-34-24/h2-9,13,17,19-20H,10-12,14-16,18H2,1H3,(H,28,29,30)/t19-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	158	n/a	n/a	n/a	n/a	n/a	n/a
Scios Inc. Curated by ChEMBL					Assay Description Inhibition of human p38alpha assessed as gamma-[32P]ATP incorporation after 60 mins by scintillation counting				Bioorg Med Chem Lett 20: 2560-3 (2010) Article DOI: 10.1016/j.bmcl.2010.02.090 BindingDB Entry DOI: 10.7270/Q2BV7GS3
					More data for this Ligand-Target Pair