BDBM50001603 2-(1-{2-[2-(5-Amino-pentanoylamino)-3-phenyl-propionylamino]-3-phenyl-propionyl}-6-oxo-1,7-diaza-spiro[4.4]non-7-yl)-4-methyl-pentanoic acid (1-carbamoyl-3-methylsulfanyl-propyl)-amide::CHEMBL133362
SMILES: CSCC[C@H](NC(=O)[C@H](CC(C)C)N1CC[C@]2(CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)CCCCN)C1=O)C(N)=O
InChI Key: InChIKey=ZYISADSNQUGMEQ-DKSOTBSCSA-N
Data: 2 EC50
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Neurokinin 2 receptor (Rattus norvegicus (Rat)) | BDBM50001603 (2-(1-{2-[2-(5-Amino-pentanoylamino)-3-phenyl-propi...) | Reactome pathway UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | n/a | n/a | 1.39E+3 | n/a | n/a | n/a | n/a |
Glaxo Group Research Curated by ChEMBL | Assay Description In vitro agonistic activity against tachykinin receptor 2 of rat colon muscularis mucosae. | J Med Chem 35: 4195-204 (1992) BindingDB Entry DOI: 10.7270/Q2NZ8883 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Neurokinin 1 receptor (GUINEA PIG) | BDBM50001603 (2-(1-{2-[2-(5-Amino-pentanoylamino)-3-phenyl-propi...) | PDB MMDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | n/a | n/a | 307 | n/a | n/a | n/a | n/a |
Glaxo Group Research Curated by ChEMBL | Assay Description In vitro agonistic activity against tachykinin receptor 1 of guinea pig ileum longitudinal smooth muscle. | J Med Chem 35: 4195-204 (1992) BindingDB Entry DOI: 10.7270/Q2NZ8883 | |||||||||||
More data for this Ligand-Target Pair |