BDBM95309 5-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-1-methyl-3-(phenylthio)indole::5-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-1-methyl-3-phenylsulfanyl-indole::5-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-1-methyl-3-phenylsulfanylindole::MLS003591619::SMR002252916::cid_53301435

SMILES: COc1ccc(cc1)-c1c(Sc2ccccc2)c2cc(ccc2n1C)-c1ccc2OCOc2c1

InChI Key: InChIKey=QTLYVTXPXXUENM-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 95309   

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
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM95309 (5-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-1-met...) Show SMILES COc1ccc(cc1)-c1c(Sc2ccccc2)c2cc(ccc2n1C)-c1ccc2OCOc2c1 Show InChI InChI=1S/C29H23NO3S/c1-30-25-14-10-20(21-11-15-26-27(17-21)33-18-32-26)16-24(25)29(34-23-6-4-3-5-7-23)28(30)19-8-12-22(31-2)13-9-19/h3-17H,18H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.87E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay									PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2KD1WJB
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM95309 (5-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-1-met...) Show SMILES COc1ccc(cc1)-c1c(Sc2ccccc2)c2cc(ccc2n1C)-c1ccc2OCOc2c1 Show InChI InChI=1S/C29H23NO3S/c1-30-25-14-10-20(21-11-15-26-27(17-21)33-18-32-26)16-24(25)29(34-23-6-4-3-5-7-23)28(30)19-8-12-22(31-2)13-9-19/h3-17H,18H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.05E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay									PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q29W0D3P
					More data for this Ligand-Target Pair
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM95309 (5-(1,3-benzodioxol-5-yl)-2-(4-methoxyphenyl)-1-met...) Show SMILES COc1ccc(cc1)-c1c(Sc2ccccc2)c2cc(ccc2n1C)-c1ccc2OCOc2c1 Show InChI InChI=1S/C29H23NO3S/c1-30-25-14-10-20(21-11-15-26-27(17-21)33-18-32-26)16-24(25)29(34-23-6-4-3-5-7-23)28(30)19-8-12-22(31-2)13-9-19/h3-17H,18H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.14E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay									PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2FN14T0
					More data for this Ligand-Target Pair