BDBM50001444 3-Amino-N-{1-[1-(1-{[(1-{[(1-carbamoyl-3-methyl-butyl)-(3-methyl-butyryl)-amino]-methyl}-3-methyl-butylcarbamoyl)-methyl]-carbamoyl}-2-methyl-propylcarbamoyl)-2-phenyl-ethylcarbamoyl]-2-hydroxy-ethyl}-succinamic acid::CHEMBL129301
SMILES: CC(C)C[C@@H](CN([C@@H](CC(C)C)C(N)=O)C(=O)CC(C)C)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(O)=O)C(C)C
InChI Key: InChIKey=PAGKTZVACGXGNS-LMOUFGHUSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
TACR2 (HAMSTER) | BDBM50001444 (3-Amino-N-{1-[1-(1-{[(1-{[(1-carbamoyl-3-methyl-bu...) | UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 162 | n/a | n/a | n/a | n/a | n/a | n/a |
Marion Merrell Dow Research Institute Curated by ChEMBL | Assay Description Competitive inhibition of [125I]NKA binding to hamster urinary bladder Tachykinin receptor 2 | J Med Chem 35: 3949-55 (1992) BindingDB Entry DOI: 10.7270/Q2FF3SZB | |||||||||||
More data for this Ligand-Target Pair |