BDBM95271 MLS000662097::N-(2,4-dimethoxyphenyl)-2-[(N-isobutylglycyl)amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide::N-(2,4-dimethoxyphenyl)-2-[2-(2-methylpropylamino)ethanoylamino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide::N-(2,4-dimethoxyphenyl)-2-[[2-(2-methylpropylamino)-1-oxoethyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide::N-(2,4-dimethoxyphenyl)-2-[[2-(2-methylpropylamino)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide::N-(2,4-dimethoxyphenyl)-2-[[2-(isobutylamino)acetyl]amino]-5,6-dihydro-4H-cyclopenta[b]thiophene-3-carboxamide::SMR000292751::cid_2942998

SMILES: COc1ccc(NC(=O)c2c(NC(=O)CNCC(C)C)sc3CCCc23)c(OC)c1

InChI Key: InChIKey=KRSJLYPWAJGBPQ-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 = 95271   

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...)	BDBM95271 (MLS000662097 | N-(2,4-dimethoxyphenyl)-2-[(N-isobu...) Show SMILES COc1ccc(NC(=O)c2c(NC(=O)CNCC(C)C)sc3CCCc23)c(OC)c1 Show InChI InChI=1S/C22H29N3O4S/c1-13(2)11-23-12-19(26)25-22-20(15-6-5-7-18(15)30-22)21(27)24-16-9-8-14(28-3)10-17(16)29-4/h8-10,13,23H,5-7,11-12H2,1-4H3,(H,24,27)(H,25,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>6.70E+4	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...)	BDBM95271 (MLS000662097 | N-(2,4-dimethoxyphenyl)-2-[(N-isobu...) Show SMILES COc1ccc(NC(=O)c2c(NC(=O)CNCC(C)C)sc3CCCc23)c(OC)c1 Show InChI InChI=1S/C22H29N3O4S/c1-13(2)11-23-12-19(26)25-22-20(15-6-5-7-18(15)30-22)21(27)24-16-9-8-14(28-3)10-17(16)29-4/h8-10,13,23H,5-7,11-12H2,1-4H3,(H,24,27)(H,25,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.18E+4	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...)	BDBM95271 (MLS000662097 | N-(2,4-dimethoxyphenyl)-2-[(N-isobu...) Show SMILES COc1ccc(NC(=O)c2c(NC(=O)CNCC(C)C)sc3CCCc23)c(OC)c1 Show InChI InChI=1S/C22H29N3O4S/c1-13(2)11-23-12-19(26)25-22-20(15-6-5-7-18(15)30-22)21(27)24-16-9-8-14(28-3)10-17(16)29-4/h8-10,13,23H,5-7,11-12H2,1-4H3,(H,24,27)(H,25,26)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.90E+4	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