BDBM50107440 CHEMBL136076::Naphthalene-2-sulfonic acid {(S)-2-[(S)-2-(4-guanidino-butylsulfanylmethyl)-pyrrolidin-1-yl]-1-hydroxymethyl-2-oxo-ethyl}-amide
SMILES: NC(=N)NCCCCSC[C@@H]1CCCN1C(=O)[C@H](CO)NS(=O)(=O)c1ccc2ccccc2c1
InChI Key: InChIKey=GYNPTMLMIWOLAM-FPOVZHCZSA-N
Data: 1 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Prothrombin (Homo sapiens (Human)) | BDBM50107440 (CHEMBL136076 | Naphthalene-2-sulfonic acid {(S)-2-...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 1.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL | Assay Description In vitro inhibition of human thrombin catalytic activity after 3 min pre incubation. | Bioorg Med Chem Lett 12: 41-4 (2001) BindingDB Entry DOI: 10.7270/Q2MP53T0 | |||||||||||
More data for this Ligand-Target Pair |