BDBM50122937 5-Phenyl-pentanoic acid (5-hydroxymethyl-2-isopropyl-1-methyl-3-oxo-1,2,3,4,5,6-hexahydro-benzo[e][1,4]diazocin-8-yl)-amide::CHEMBL333801

SMILES: CC(C)[C@@H]1N(C)c2ccc(NC(=O)CCCCc3ccccc3)cc2C[C@@H](CO)NC1=O

InChI Key: InChIKey=CRPJNMJMYOTWPH-DHLKQENFSA-N

Data: 1 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 1 hit for monomerid = 50122937   

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
Protein kinase C alpha type (Homo sapiens (Human))	BDBM50122937 (5-Phenyl-pentanoic acid (5-hydroxymethyl-2-isoprop...) Show SMILES CC(C)[C@@H]1N(C)c2ccc(NC(=O)CCCCc3ccccc3)cc2C[C@@H](CO)NC1=O Show InChI InChI=1S/C26H35N3O3/c1-18(2)25-26(32)28-22(17-30)16-20-15-21(13-14-23(20)29(25)3)27-24(31)12-8-7-11-19-9-5-4-6-10-19/h4-6,9-10,13-15,18,22,25,30H,7-8,11-12,16-17H2,1-3H3,(H,27,31)(H,28,32)/t22-,25-/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 Similars	Article PubMed	34	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Georgetown University Medical Center Curated by ChEMBL					Assay Description Displacement of PDBU from recombinant Protein kinase C alpha with phosphatidylserine				J Med Chem 46: 364-73 (2003) Article DOI: 10.1021/jm020350r BindingDB Entry DOI: 10.7270/Q20864P8
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