BDBM43853 3-[(4-chlorophenyl)sulfonylamino]propanoic acid [2-(4-methoxyanilino)-2-oxoethyl] ester::3-[(4-chlorophenyl)sulfonylamino]propionic acid [2-keto-2-(p-anisidino)ethyl] ester::MLS000761252::SMR000369563::TL-3::[2-(4-methoxyanilino)-2-oxoethyl] 3-[(4-chlorophenyl)sulfonylamino]propanoate::[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl] 3-[(4-chlorophenyl)sulfonylamino]propanoate::cid_2122335

SMILES: COc1ccc(NC(=O)COC(=O)CCNS(=O)(=O)c2ccc(Cl)cc2)cc1

InChI Key: InChIKey=UPTBHMYAPKZWMG-UHFFFAOYSA-N

Data: 1 KI  1 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 = 43853   

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
HIV-1 protease (Human immunodeficiency virus)	BDBM43853 (3-[(4-chlorophenyl)sulfonylamino]propanoic acid [2...) Show SMILES COc1ccc(NC(=O)COC(=O)CCNS(=O)(=O)c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C18H19ClN2O6S/c1-26-15-6-4-14(5-7-15)21-17(22)12-27-18(23)10-11-20-28(24,25)16-8-2-13(19)3-9-16/h2-9,20H,10-12H2,1H3,(H,21,22)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	1.5	-12.5	n/a	n/a	n/a	n/a	n/a	5.6	37
The Scripps Research Institute					Assay Description Inhibition of HIV-protease activity for selected acids at P3-P3' positions.				Chem Biol 9: 891-6 (2002) Article DOI: 10.1016/S1074-5521(02)00184-9 BindingDB Entry DOI: 10.7270/Q2GM85QP
					More data for this Ligand-Target Pair
DNA repair protein RAD51 homolog 1 (Homo sapiens (Human))	BDBM43853 (3-[(4-chlorophenyl)sulfonylamino]propanoic acid [2...) Show SMILES COc1ccc(NC(=O)COC(=O)CCNS(=O)(=O)c2ccc(Cl)cc2)cc1 Show InChI InChI=1S/C18H19ClN2O6S/c1-26-15-6-4-14(5-7-15)21-17(22)12-27-18(23)10-11-20-28(24,25)16-8-2-13(19)3-9-16/h2-9,20H,10-12H2,1H3,(H,21,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	5.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
PCMD Curated by PubChem BioAssay					Assay Description Project Title: A screen for modulators of human Rad51, a key DNA repair protein Application Number: MH084119 Assay Submitter: Dr. Alex Mazin Submitte...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q2QN6558
					More data for this Ligand-Target Pair