BDBM50048890 Acetic acid 2-hydroxymethyl-5-oxo-4-tetradec-(E)-ylidene-tetrahydro-furan-2-ylmethyl ester::CHEMBL49904

SMILES: CCCCCCCCCCCCC\C=C1/CC(CO)(COC(C)=O)OC1=O

InChI Key: InChIKey=CANHUQMSCFNKBO-HMMYKYKNSA-N

Data: 3 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 3 hits for monomerid = 50048890   

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))	BDBM50048890 (Acetic acid 2-hydroxymethyl-5-oxo-4-tetradec-(E)-y...) Show SMILES CCCCCCCCCCCCC\C=C1/CC(CO)(COC(C)=O)OC1=O Show InChI InChI=1S/C22H38O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-20-16-22(17-23,27-21(20)25)18-26-19(2)24/h15,23H,3-14,16-18H2,1-2H3/b20-15+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	78	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of [20-3H]phorbol12,13-dibutyrate from a recombinant PK-C alpha				Bioorg Med Chem Lett 8: 1757-62 (1999) BindingDB Entry DOI: 10.7270/Q2TH8KT2
					More data for this Ligand-Target Pair
Protein kinase C alpha type (Homo sapiens (Human))	BDBM50048890 (Acetic acid 2-hydroxymethyl-5-oxo-4-tetradec-(E)-y...) Show SMILES CCCCCCCCCCCCC\C=C1/CC(CO)(COC(C)=O)OC1=O Show InChI InChI=1S/C22H38O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-20-16-22(17-23,27-21(20)25)18-26-19(2)24/h15,23H,3-14,16-18H2,1-2H3/b20-15+	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	78	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute Curated by ChEMBL					Assay Description Displacement of [H-20]phorbol12,13-dibutyrate (PDBU) from Protein kinase C alpha				J Med Chem 39: 19-28 (1996) Article DOI: 10.1021/jm950276v BindingDB Entry DOI: 10.7270/Q2K64H5X
					More data for this Ligand-Target Pair
Protein kinase C alpha type (Homo sapiens (Human))	BDBM50048890 (Acetic acid 2-hydroxymethyl-5-oxo-4-tetradec-(E)-y...) Show SMILES CCCCCCCCCCCCC\C=C1/CC(CO)(COC(C)=O)OC1=O Show InChI InChI=1S/C22H38O5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-20-16-22(17-23,27-21(20)25)18-26-19(2)24/h15,23H,3-14,16-18H2,1-2H3/b20-15+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	78	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Institutes of Health Curated by ChEMBL					Assay Description Displacement of [20-3H]-phorbol 12,13-dibutyrate (PDBU) from PKCalpha (C1b domain)				Bioorg Med Chem Lett 8: 3403-8 (1999) BindingDB Entry DOI: 10.7270/Q2C24VMN
					More data for this Ligand-Target Pair