BDBM50245020 (E)-(2-(hydroxymethyl)-5-oxo-4-(quinolin-2-ylmethylene)-tetrahydrofuran-2-yl)methyl 2-propylpentanoate::CHEMBL529000

SMILES: CCCC(CCC)C(=O)OCC1(CO)C\C(=C/c2ccc3ccccc3n2)C(=O)O1

InChI Key: InChIKey=DRXBCTFIEPSCHE-CPNJWEJPSA-N

Data: 2 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 2 hits for monomerid = 50245020   

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
RAS guanyl releasing protein 3 (Homo sapiens (Human))	BDBM50245020 ((E)-(2-(hydroxymethyl)-5-oxo-4-(quinolin-2-ylmethy...) Show SMILES CCCC(CCC)C(=O)OCC1(CO)C\C(=C/c2ccc3ccccc3n2)C(=O)O1 Show InChI InChI=1S/C24H29NO5/c1-3-7-18(8-4-2)22(27)29-16-24(15-26)14-19(23(28)30-24)13-20-12-11-17-9-5-6-10-21(17)25-20/h5-6,9-13,18,26H,3-4,7-8,14-16H2,1-2H3/b19-13+	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute at Frederick Curated by ChEMBL					Assay Description Displacement of [3H]PDBu from RasGRP3 (unknown origin) expressed in cells				J Med Chem 51: 5371-86 (2008) Article DOI: 10.1021/jm800380b BindingDB Entry DOI: 10.7270/Q21V5DSQ
					More data for this Ligand-Target Pair
Protein kinase C alpha type (Homo sapiens (Human))	BDBM50245020 ((E)-(2-(hydroxymethyl)-5-oxo-4-(quinolin-2-ylmethy...) Show SMILES CCCC(CCC)C(=O)OCC1(CO)C\C(=C/c2ccc3ccccc3n2)C(=O)O1 Show InChI InChI=1S/C24H29NO5/c1-3-7-18(8-4-2)22(27)29-16-24(15-26)14-19(23(28)30-24)13-20-12-11-17-9-5-6-10-21(17)25-20/h5-6,9-13,18,26H,3-4,7-8,14-16H2,1-2H3/b19-13+	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	52	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
National Cancer Institute at Frederick Curated by ChEMBL					Assay Description Displacement of [3H]PDBu from human recombinant PKCalpha expressed in Escherichia coli BL21-21-Gold (DE3)				J Med Chem 51: 5371-86 (2008) Article DOI: 10.1021/jm800380b BindingDB Entry DOI: 10.7270/Q21V5DSQ
					More data for this Ligand-Target Pair