BDBM50173813 (E)-5-[1-(3-cyanophenyl)-5-methoxycarbonylpent-1-enyl]-2-methoxy-3-methylbenzoic acid methyl este::5-[(E)-1-(3-Cyano-phenyl)-5-methoxycarbonyl-pent-1-enyl]-2-methoxy-3-methyl-benzoic acid methyl ester::CHEMBL198050

SMILES: COC(=O)CCC\C=C(/c1cccc(c1)C#N)c1cc(C)c(OC)c(c1)C(=O)OC

InChI Key: InChIKey=JZDMMDXEJWYZDI-KEBDBYFISA-N

Data: 2 IC50

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 = 50173813   

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
Human immunodeficiency virus type 1 reverse transcriptase (Human immunodeficiency virus 1)	BDBM50173813 ((E)-5-[1-(3-cyanophenyl)-5-methoxycarbonylpent-1-e...) Show SMILES COC(=O)CCC\C=C(/c1cccc(c1)C#N)c1cc(C)c(OC)c(c1)C(=O)OC Show InChI InChI=1S/C24H25NO5/c1-16-12-19(14-21(23(16)29-3)24(27)30-4)20(10-5-6-11-22(26)28-2)18-9-7-8-17(13-18)15-25/h7-10,12-14H,5-6,11H2,1-4H3/b20-10+	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	540	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV1 reverse transcriptase measured as inhibition of incorporation of [32P]GTP in rCDG primer				J Med Chem 49: 5316-23 (2006) Article DOI: 10.1021/jm060449o BindingDB Entry DOI: 10.7270/Q2QV3M5K
					More data for this Ligand-Target Pair
Human immunodeficiency virus type 1 reverse transcriptase (Human immunodeficiency virus 1)	BDBM50173813 ((E)-5-[1-(3-cyanophenyl)-5-methoxycarbonylpent-1-e...) Show SMILES COC(=O)CCC\C=C(/c1cccc(c1)C#N)c1cc(C)c(OC)c(c1)C(=O)OC Show InChI InChI=1S/C24H25NO5/c1-16-12-19(14-21(23(16)29-3)24(27)30-4)20(10-5-6-11-22(26)28-2)18-9-7-8-17(13-18)15-25/h7-10,12-14H,5-6,11H2,1-4H3/b20-10+	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	840	n/a	n/a	n/a	n/a	n/a	n/a
Purdue University Curated by ChEMBL					Assay Description Inhibition of recombinant HIV-1 reverse transcriptase activity				J Med Chem 48: 6140-55 (2005) Article DOI: 10.1021/jm050452s BindingDB Entry DOI: 10.7270/Q2TB16F6
					More data for this Ligand-Target Pair