BDBM50059769 CHEMBL3393745

SMILES: CCCCCC1OC1CC1OC1CCCCCCCC(=O)OCC1(CO)C\C(=C/CC(C)C)C(=O)O1

InChI Key: InChIKey=IPBIYLHQBHMHCN-CJLVFECKSA-N

Data: 4 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 4 hits for monomerid = 50059769   

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, epsilon (Homo sapiens (Human))	BDBM50059769 (CHEMBL3393745) Show SMILES CCCCCC1OC1CC1OC1CCCCCCCC(=O)OCC1(CO)C\C(=C/CC(C)C)C(=O)O1 Show InChI InChI=1S/C29H48O7/c1-4-5-9-12-23-25(34-23)17-26-24(35-26)13-10-7-6-8-11-14-27(31)33-20-29(19-30)18-22(28(32)36-29)16-15-21(2)3/h16,21,23-26,30H,4-15,17-20H2,1-3H3/b22-16+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	7.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Seoul National University Curated by ChEMBL					Assay Description Displacement of [20-3H] phorbol 12, 13-dibutylate from recombinant PKCepsilon (unknown origin) in presence of 100 ug/ml 100% phosphatidylserine				Eur J Med Chem 90: 332-41 (2015) Article DOI: 10.1016/j.ejmech.2014.11.025 BindingDB Entry DOI: 10.7270/Q2930VV0
					More data for this Ligand-Target Pair
Protein kinase C alpha type (Homo sapiens (Human))	BDBM50059769 (CHEMBL3393745) Show SMILES CCCCCC1OC1CC1OC1CCCCCCCC(=O)OCC1(CO)C\C(=C/CC(C)C)C(=O)O1 Show InChI InChI=1S/C29H48O7/c1-4-5-9-12-23-25(34-23)17-26-24(35-26)13-10-7-6-8-11-14-27(31)33-20-29(19-30)18-22(28(32)36-29)16-15-21(2)3/h16,21,23-26,30H,4-15,17-20H2,1-3H3/b22-16+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Seoul National University Curated by ChEMBL					Assay Description Displacement of [20-3H] phorbol 12, 13-dibutylate from recombinant PKCalpha (unknown origin) in presence of 100 ug/ml 100% phosphatidylserine				Eur J Med Chem 90: 332-41 (2015) Article DOI: 10.1016/j.ejmech.2014.11.025 BindingDB Entry DOI: 10.7270/Q2930VV0
					More data for this Ligand-Target Pair
Protein kinase C, epsilon (Homo sapiens (Human))	BDBM50059769 (CHEMBL3393745) Show SMILES CCCCCC1OC1CC1OC1CCCCCCCC(=O)OCC1(CO)C\C(=C/CC(C)C)C(=O)O1 Show InChI InChI=1S/C29H48O7/c1-4-5-9-12-23-25(34-23)17-26-24(35-26)13-10-7-6-8-11-14-27(31)33-20-29(19-30)18-22(28(32)36-29)16-15-21(2)3/h16,21,23-26,30H,4-15,17-20H2,1-3H3/b22-16+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	17	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Seoul National University Curated by ChEMBL					Assay Description Displacement of [20-3H] phorbol 12, 13-dibutylate from recombinant PKCepsilon (unknown origin) in presence of nuclear membrane mimetic lipid mixture				Eur J Med Chem 90: 332-41 (2015) Article DOI: 10.1016/j.ejmech.2014.11.025 BindingDB Entry DOI: 10.7270/Q2930VV0
					More data for this Ligand-Target Pair
Protein kinase C alpha type (Homo sapiens (Human))	BDBM50059769 (CHEMBL3393745) Show SMILES CCCCCC1OC1CC1OC1CCCCCCCC(=O)OCC1(CO)C\C(=C/CC(C)C)C(=O)O1 Show InChI InChI=1S/C29H48O7/c1-4-5-9-12-23-25(34-23)17-26-24(35-26)13-10-7-6-8-11-14-27(31)33-20-29(19-30)18-22(28(32)36-29)16-15-21(2)3/h16,21,23-26,30H,4-15,17-20H2,1-3H3/b22-16+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	116	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Seoul National University Curated by ChEMBL					Assay Description Displacement of [20-3H] phorbol 12, 13-dibutylate from recombinant PKCalpha (unknown origin) in presence of nuclear membrane mimetic lipid mixture				Eur J Med Chem 90: 332-41 (2015) Article DOI: 10.1016/j.ejmech.2014.11.025 BindingDB Entry DOI: 10.7270/Q2930VV0
					More data for this Ligand-Target Pair