BDBM50315944 CHEMBL1090231::N-(2-((S)-1-phenylethylamino)pyrimidin-4-yl)-N-(piperidin-3-ylmethyl)-2,3-dihydrobenzofuran-5-carboxamide

SMILES: C[C@H](Nc1nccc(n1)N(CC1CCCNC1)C(=O)c1ccc2OCCc2c1)c1ccccc1

InChI Key: InChIKey=TWZNWJOWCOVCBL-XJDOXCRVSA-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 = 50315944   

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))	BDBM50315944 (CHEMBL1090231 | N-(2-((S)-1-phenylethylamino)pyrim...) Show SMILES C[C@H](Nc1nccc(n1)N(CC1CCCNC1)C(=O)c1ccc2OCCc2c1)c1ccccc1 |r| Show InChI InChI=1S/C27H31N5O2/c1-19(21-7-3-2-4-8-21)30-27-29-14-11-25(31-27)32(18-20-6-5-13-28-17-20)26(33)23-9-10-24-22(16-23)12-15-34-24/h2-4,7-11,14,16,19-20,28H,5-6,12-13,15,17-18H2,1H3,(H,29,30,31)/t19-,20?/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	>1.00E+4	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