BDBM50105321 CHEMBL88513::N-(4-{3-Cyclopropyl-3-[(S)-2-(3,4-dichloro-phenyl)-2-hydroxy-ethyl]-ureido}-benzyl)-2,2-dimethyl-propionamide
SMILES: CC(C)(C)C(=O)NCc1ccc(NC(=O)N(C[C@@H](O)c2ccc(Cl)c(Cl)c2)C2CC2)cc1
InChI Key: InChIKey=JHEHVQHFEQIHDF-OAQYLSRUSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Proteinase-activated receptor 1 (Homo sapiens (Human)) | BDBM50105321 (CHEMBL88513 | N-(4-{3-Cyclopropyl-3-[(S)-2-(3,4-di...) | PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | n/a | n/a | 2.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories Curated by ChEMBL | Assay Description Binding affinity of the compound against platelet thrombin receptor | Bioorg Med Chem Lett 11: 2691-6 (2001) BindingDB Entry DOI: 10.7270/Q26Q1WJ1 | |||||||||||
More data for this Ligand-Target Pair |