BDBM86417 5-amino-2-{1-[1-[1-amino-2-(4-hydroxyphenyl)ethylcarboxamido]-4-amino(imino)methylamino-(1R)-butylcarboxamido]-2-phenylethylcarboxamido}pentanamide::CHEMBL2371282::Tyr-d-Arg-Phe-Orn-NH2
SMILES: [#7]-[#6]-[#6]-[#6]-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-c1ccccc1)-[#7]-[#6](=O)-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](\[#7])-[#7])-[#7]-[#6](=O)-[#6@@H](-[#7])-[#6]-c1ccc(-[#8])cc1)-[#6](-[#7])=O
InChI Key: InChIKey=LCKZFWNZLABYEW-XQUALCHDSA-N
Data: 4 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) | BDBM86417 (5-amino-2-{1-[1-[1-amino-2-(4-hydroxyphenyl)ethylc...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cornell University Curated by PDSP Ki Database | J Pharmacol Exp Ther 307: 947-54 (2003) Article DOI: 10.1124/jpet.103.054775 BindingDB Entry DOI: 10.7270/Q24748FX | ||||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mu-type opioid receptor (Rattus norvegicus (rat)) | BDBM86417 (5-amino-2-{1-[1-[1-amino-2-(4-hydroxyphenyl)ethylc...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 1.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Clinical Research Institute of Montreal Curated by ChEMBL | Assay Description Binding affinity against opioid receptor mu by displacement of radioligand [3H]-DAGO in rat brain membrane | J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Mu-type opioid receptor (MOUSE) | BDBM86417 (5-amino-2-{1-[1-[1-amino-2-(4-hydroxyphenyl)ethylc...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 10.4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Cornell University Curated by PDSP Ki Database | J Pharmacol Exp Ther 307: 947-54 (2003) Article DOI: 10.1124/jpet.103.054775 BindingDB Entry DOI: 10.7270/Q24748FX | ||||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Opioid receptors; mu & delta (Rattus norvegicus (rat)) | BDBM86417 (5-amino-2-{1-[1-[1-amino-2-(4-hydroxyphenyl)ethylc...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 9.29E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Clinical Research Institute of Montreal Curated by ChEMBL | Assay Description Binding affinity against opioid receptor delta by displacement of radioligand [3H]-DSLET in rat brain membrane | J Med Chem 32: 698-703 (1989) BindingDB Entry DOI: 10.7270/Q29W0DGM | |||||||||||
More data for this Ligand-Target Pair |