BDBM50073872 (4S,5aS,5bS,7aS,10aS,10bS,12aS)-4-Hydroxymethyl-5a,7a-dimethyl-hexadecahydro-cyclopenta[5,6]naphtho[1,2-d]azepin-2-one::CHEMBL48622

SMILES: C[C@@]12CCC[C@H]1[C@@H]1CC[C@H]3CC(=O)N[C@H](CO)C[C@]3(C)[C@H]1CC2

InChI Key: InChIKey=CPSBWXAVJYWNOH-WSVRAQSBSA-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 = 50073872   

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))	BDBM50073872 ((4S,5aS,5bS,7aS,10aS,10bS,12aS)-4-Hydroxymethyl-5a...) Show SMILES C[C@@]12CCC[C@H]1[C@@H]1CC[C@H]3CC(=O)N[C@H](CO)C[C@]3(C)[C@H]1CC2 Show InChI InChI=1S/C20H33NO2/c1-19-8-3-4-16(19)15-6-5-13-10-18(23)21-14(12-22)11-20(13,2)17(15)7-9-19/h13-17,22H,3-12H2,1-2H3,(H,21,23)/t13-,14-,15-,16-,17-,19-,20-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Tokyo Curated by ChEMBL					Assay Description Displacement of [3H]-PDBu from human recombinant Protein kinase C alpha				Bioorg Med Chem Lett 9: 173-8 (1999) BindingDB Entry DOI: 10.7270/Q2WQ02Z9
					More data for this Ligand-Target Pair