BDBM43842 Acid, 24::MLS001010895::N-(1,1-diketothiolan-3-yl)-N-methyl-2-[[4-phenyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetamide::N-(1,1-dioxo-3-thiolanyl)-N-methyl-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]acetamide::N-(1,1-dioxothiolan-3-yl)-N-methyl-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide::N-[1,1-bis(oxidanylidene)thiolan-3-yl]-N-methyl-2-[(4-phenyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide::SMR000352944::cid_4409405

SMILES: CN(C1CCS(=O)(=O)C1)C(=O)CSc1nnc(-c2ccncc2)n1-c1ccccc1

InChI Key: InChIKey=XZYHDXZNNDZXSR-UHFFFAOYSA-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 = 43842   

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
DNA repair protein RAD51 homolog 1 (Homo sapiens (Human))	BDBM43842 (Acid, 24 | MLS001010895 | N-(1,1-diketothiolan-3-y...) Show SMILES CN(C1CCS(=O)(=O)C1)C(=O)CSc1nnc(-c2ccncc2)n1-c1ccccc1 Show InChI InChI=1S/C20H21N5O3S2/c1-24(17-9-12-30(27,28)14-17)18(26)13-29-20-23-22-19(15-7-10-21-11-8-15)25(20)16-5-3-2-4-6-16/h2-8,10-11,17H,9,12-14H2,1H3	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
HIV-1 protease (Human immunodeficiency virus)	BDBM43842 (Acid, 24 | MLS001010895 | N-(1,1-diketothiolan-3-y...) Show SMILES CN(C1CCS(=O)(=O)C1)C(=O)CSc1nnc(-c2ccncc2)n1-c1ccccc1 Show InChI InChI=1S/C20H21N5O3S2/c1-24(17-9-12-30(27,28)14-17)18(26)13-29-20-23-22-19(15-7-10-21-11-8-15)25(20)16-5-3-2-4-6-16/h2-8,10-11,17H,9,12-14H2,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	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