BDBM50073525 2-({1-[2-(2-{2-[2-(2-Amino-2-[4-hydroxy-phenyl]-acetylamino)-propionylamino]-2-phenyl-acetylamino}-acetylamino)-3-(4-hydroxy-phenyl)-propionyl]-pyrrolidine-2-carbonyl}-amino)-propionic acid 3-acetoxy-4,5,6-trihydroxy-tetrahydro-pyran-2-ylmethyl ester::CHEMBL402691
SMILES: C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)OC[C@H]1O[C@H](O)[C@H](O)[C@@H](O)[C@H]1OC(C)=O
InChI Key: InChIKey=LIYLVOWXHSIANO-NXOFSWEKSA-N
Data: 2 KI
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Mu-type opioid receptor (MOUSE) | BDBM50073525 (2-({1-[2-(2-{2-[2-(2-Amino-2-[4-hydroxy-phenyl]-ac...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 11.2 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University "La Sapienza" of Rome Curated by ChEMBL | Assay Description Displacement of [3H]-DAGO from Opioid receptor mu 1 of adult male mouse brain. | J Med Chem 42: 400-4 (1999) Article DOI: 10.1021/jm9810699 BindingDB Entry DOI: 10.7270/Q2KD1X2G | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Delta-type opioid receptor (MOUSE) | BDBM50073525 (2-({1-[2-(2-{2-[2-(2-Amino-2-[4-hydroxy-phenyl]-ac...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | >5.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University "La Sapienza" of Rome Curated by ChEMBL | Assay Description Displacement of [3H]-NLT from Opioid receptor delta 1 of adult male mouse brain. | J Med Chem 42: 400-4 (1999) Article DOI: 10.1021/jm9810699 BindingDB Entry DOI: 10.7270/Q2KD1X2G | |||||||||||
More data for this Ligand-Target Pair |