BDBM50455191 CHEMBL2371014

SMILES: C[C@@H]([C@@H](N)C(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)c1ccc(O)cc1

InChI Key: InChIKey=OWGXIRLGXGMAHA-JNSKMMGSSA-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 = 50455191   

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
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50455191 (CHEMBL2371014) Show SMILES C[C@@H]([C@@H](N)C(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)c1ccc(O)cc1 Show InChI InChI=1S/C38H41N5O5/c1-24(27-16-18-30(44)19-17-27)34(39)38(48)43-23-29-15-9-8-14-28(29)22-33(43)37(47)42-32(21-26-12-6-3-7-13-26)36(46)41-31(35(40)45)20-25-10-4-2-5-11-25/h2-19,24,31-34,44H,20-23,39H2,1H3,(H2,40,45)(H,41,46)(H,42,47)/t24-,31+,32+,33+,34-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	28	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Brussel Curated by ChEMBL					Assay Description Binding affinity towards human Opioid receptor delta 1 on NxG108CC15 (human neuroglioblastoma) cell membranes by [3H]DPDPE displacement.				J Med Chem 41: 5167-76 (1999) Article DOI: 10.1021/jm981011u BindingDB Entry DOI: 10.7270/Q2XK8G7T
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50455191 (CHEMBL2371014) Show SMILES C[C@@H]([C@@H](N)C(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)c1ccc(O)cc1 Show InChI InChI=1S/C38H41N5O5/c1-24(27-16-18-30(44)19-17-27)34(39)38(48)43-23-29-15-9-8-14-28(29)22-33(43)37(47)42-32(21-26-12-6-3-7-13-26)36(46)41-31(35(40)45)20-25-10-4-2-5-11-25/h2-19,24,31-34,44H,20-23,39H2,1H3,(H2,40,45)(H,41,46)(H,42,47)/t24-,31+,32+,33+,34-/m1/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.18E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Brussel Curated by ChEMBL					Assay Description Binding affinity towards Opioid receptor kappa 1 on guinea pig cerebellum membranes by [3H]U-69593 displacement.				J Med Chem 41: 5167-76 (1999) Article DOI: 10.1021/jm981011u BindingDB Entry DOI: 10.7270/Q2XK8G7T
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50455191 (CHEMBL2371014) Show SMILES C[C@@H]([C@@H](N)C(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(N)=O)c1ccc(O)cc1 Show InChI InChI=1S/C38H41N5O5/c1-24(27-16-18-30(44)19-17-27)34(39)38(48)43-23-29-15-9-8-14-28(29)22-33(43)37(47)42-32(21-26-12-6-3-7-13-26)36(46)41-31(35(40)45)20-25-10-4-2-5-11-25/h2-19,24,31-34,44H,20-23,39H2,1H3,(H2,40,45)(H,41,46)(H,42,47)/t24-,31+,32+,33+,34-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Vrije Universiteit Brussel Curated by ChEMBL					Assay Description Binding affinity towards Opioid receptor mu 1 on rat forebrain membranes by [3H]sufentanil displacement.				J Med Chem 41: 5167-76 (1999) Article DOI: 10.1021/jm981011u BindingDB Entry DOI: 10.7270/Q2XK8G7T
					More data for this Ligand-Target Pair