BDBM50105765 4-[5-(2-Amino-pyrimidin-4-yl)-4-(4-fluoro-phenyl)-imidazol-1-yl]-cyclohexanol::CHEMBL319988

SMILES: Nc1nccc(n1)-c1c(ncn1[C@H]1CC[C@H](O)CC1)-c1ccc(F)cc1

InChI Key: InChIKey=YNEJNUAUXPCFAS-SHTZXODSSA-N

Data: 1 IC50

PDB links: 1 PDB ID matches this monomer.

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 = 50105765   

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))	BDBM50105765 (4-[5-(2-Amino-pyrimidin-4-yl)-4-(4-fluoro-phenyl)-...) Show SMILES Nc1nccc(n1)-c1c(ncn1[C@H]1CC[C@H](O)CC1)-c1ccc(F)cc1 |wU:12.13,wD:15.17,(1.9,1.09,;3.25,1.84,;3.27,3.4,;4.62,4.13,;5.95,3.33,;5.91,1.79,;4.56,1.05,;7.24,1,;7.45,-.54,;8.94,-.82,;9.68,.53,;8.63,1.65,;8.92,3.17,;7.75,4.15,;8.06,5.69,;9.52,6.17,;9.81,7.68,;10.67,5.17,;10.39,3.66,;6.38,-1.64,;6.8,-3.13,;5.72,-4.22,;4.25,-3.83,;3.18,-4.95,;3.81,-2.36,;4.88,-1.27,)| Show InChI InChI=1S/C19H20FN5O/c20-13-3-1-12(2-4-13)17-18(16-9-10-22-19(21)24-16)25(11-23-17)14-5-7-15(26)8-6-14/h1-4,9-11,14-15,26H,5-8H2,(H2,21,22,24)/t14-,15-	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	83	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition against Mitogen-activated protein kinase p38 alpha				Bioorg Med Chem Lett 11: 2867-70 (2001) BindingDB Entry DOI: 10.7270/Q28G8K1F
					More data for this Ligand-Target Pair