BDBM50356332 CHEMBL1911252::CHEMBL554140
SMILES: [#6]-[#8]-[#6](=O)-c1ccc(-[#8]-[#6](=O)-c2ccc(cc2)\[#7]=[#6](\[#7])-[#7])cc1
InChI Key: InChIKey=NIBWPUGZCXNNPC-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Acrosin (Homo sapiens (Human)) | BDBM50356332 (CHEMBL1911252 | CHEMBL554140) | Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 2.70E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Second Military Medical University Curated by ChEMBL | Assay Description Inhibition of acrosin activity in human spermatozoa using N-alpha-benzoyl-DL-arginine para-nitroanilide-HCI as a substrate after 3 hrs by spectrophot... | Bioorg Med Chem Lett 21: 6674-7 (2011) Article DOI: 10.1016/j.bmcl.2011.09.060 BindingDB Entry DOI: 10.7270/Q2TT4RBF | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Acrosin (Homo sapiens (Human)) | BDBM50356332 (CHEMBL1911252 | CHEMBL554140) | Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 0.670 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Inhibition of human acrosin and control activity being 11.3 umol/min/mg | J Med Chem 29: 514-9 (1986) BindingDB Entry DOI: 10.7270/Q20C4WZ7 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Trypsin-1 (Homo sapiens (Human)) | BDBM50356332 (CHEMBL1911252 | CHEMBL554140) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 1.5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Inhibition of human trypsin and the control activity being 7.3 umol/min/mg | J Med Chem 29: 514-9 (1986) BindingDB Entry DOI: 10.7270/Q20C4WZ7 | |||||||||||
More data for this Ligand-Target Pair |