BDBM50071093 CHEMBL3409764

SMILES: Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N1CCc2ccccc2C1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](CC(N)=O)Cc1ccccc1

InChI Key: InChIKey=DXGQBZMYRUPLTA-RWZLTNLOSA-N

Data: 3 KI

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50071093   

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
Opioid receptors; mu & delta (Rattus norvegicus (rat))	BDBM50071093 (CHEMBL3409764) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N1CCc2ccccc2C1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](CC(N)=O)Cc1ccccc1 |r| Show InChI InChI=1S/C40H45N5O5/c1-25-19-31(46)20-26(2)33(25)24-34(41)40(50)45-18-17-29-15-9-10-16-32(29)37(45)39(49)44-35(22-28-13-7-4-8-14-28)38(48)43-30(23-36(42)47)21-27-11-5-3-6-12-27/h3-16,19-20,30,34-35,37,46H,17-18,21-24,41H2,1-2H3,(H2,42,47)(H,43,48)(H,44,49)/t30-,34-,35-,37?/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Displacement of [3H]DPDPE from rat cortex delta opioid receptor after 2.5 hrs by liquid scintillation counting analysis				Eur J Med Chem 92: 270-81 (2015) Article DOI: 10.1016/j.ejmech.2014.12.049 BindingDB Entry DOI: 10.7270/Q22B90RZ
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50071093 (CHEMBL3409764) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N1CCc2ccccc2C1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](CC(N)=O)Cc1ccccc1 |r| Show InChI InChI=1S/C40H45N5O5/c1-25-19-31(46)20-26(2)33(25)24-34(41)40(50)45-18-17-29-15-9-10-16-32(29)37(45)39(49)44-35(22-28-13-7-4-8-14-28)38(48)43-30(23-36(42)47)21-27-11-5-3-6-12-27/h3-16,19-20,30,34-35,37,46H,17-18,21-24,41H2,1-2H3,(H2,42,47)(H,43,48)(H,44,49)/t30-,34-,35-,37?/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	15	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from rat cortex mu opioid receptor after 30 mins by liquid scintillation counting analysis				Eur J Med Chem 92: 270-81 (2015) Article DOI: 10.1016/j.ejmech.2014.12.049 BindingDB Entry DOI: 10.7270/Q22B90RZ
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50071093 (CHEMBL3409764) Show SMILES Cc1cc(O)cc(C)c1C[C@H](N)C(=O)N1CCc2ccccc2C1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](CC(N)=O)Cc1ccccc1 |r| Show InChI InChI=1S/C40H45N5O5/c1-25-19-31(46)20-26(2)33(25)24-34(41)40(50)45-18-17-29-15-9-10-16-32(29)37(45)39(49)44-35(22-28-13-7-4-8-14-28)38(48)43-30(23-36(42)47)21-27-11-5-3-6-12-27/h3-16,19-20,30,34-35,37,46H,17-18,21-24,41H2,1-2H3,(H2,42,47)(H,43,48)(H,44,49)/t30-,34-,35-,37?/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Displacement of [3H]U69,593 from guinea pig cortex/cerebella kappa opioid receptor after 2 hrs by liquid scintillation counting analysis				Eur J Med Chem 92: 270-81 (2015) Article DOI: 10.1016/j.ejmech.2014.12.049 BindingDB Entry DOI: 10.7270/Q22B90RZ
					More data for this Ligand-Target Pair