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
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...) | 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...) | 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...) | 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 |