BDBM50034243 (S)-3-((S)-2-{(S)-2-[(S)-2-Amino-3-(4-hydroxy-phenyl)-propionylamino]-propionylamino}-3-pentamethylphenyl-propionylamino)-N-{(S)-1-[(S)-1-(carbamoylmethyl-carbamoyl)-2-methyl-propylcarbamoyl]-2-methyl-propyl}-succinamic acid::CHEMBL281634

SMILES: CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1c(C)c(C)c(C)c(C)c1C)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(=O)NCC(N)=O

InChI Key: InChIKey=GLVGLEWNIBLSII-JMJHPKHCSA-N

Data: 6 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 6 hits for monomerid = 50034243   

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))	BDBM50034243 ((S)-3-((S)-2-{(S)-2-[(S)-2-Amino-3-(4-hydroxy-phen...) Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1c(C)c(C)c(C)c(C)c1C)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(=O)NCC(N)=O Show InChI InChI=1S/C42H62N8O10/c1-19(2)35(41(59)45-18-33(44)52)50-42(60)36(20(3)4)49-40(58)32(17-34(53)54)48-39(57)31(16-29-24(8)22(6)21(5)23(7)25(29)9)47-37(55)26(10)46-38(56)30(43)15-27-11-13-28(51)14-12-27/h11-14,19-20,26,30-32,35-36,51H,15-18,43H2,1-10H3,(H2,44,52)(H,45,59)(H,46,56)(H,47,55)(H,48,57)(H,49,58)(H,50,60)(H,53,54)/t26-,30-,31-,32-,35-,36-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.07E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Eastern Michigan University Curated by ChEMBL					Assay Description Inhibition of [3H]- DPDPE binding to delta opioid receptor of guinea pig brain				J Med Chem 38: 1242-6 (1995) BindingDB Entry DOI: 10.7270/Q21835J2
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50034243 ((S)-3-((S)-2-{(S)-2-[(S)-2-Amino-3-(4-hydroxy-phen...) Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1c(C)c(C)c(C)c(C)c1C)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(=O)NCC(N)=O Show InChI InChI=1S/C42H62N8O10/c1-19(2)35(41(59)45-18-33(44)52)50-42(60)36(20(3)4)49-40(58)32(17-34(53)54)48-39(57)31(16-29-24(8)22(6)21(5)23(7)25(29)9)47-37(55)26(10)46-38(56)30(43)15-27-11-13-28(51)14-12-27/h11-14,19-20,26,30-32,35-36,51H,15-18,43H2,1-10H3,(H2,44,52)(H,45,59)(H,46,56)(H,47,55)(H,48,57)(H,49,58)(H,50,60)(H,53,54)/t26-,30-,31-,32-,35-,36-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.07E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Eastern Michigan University Curated by ChEMBL					Assay Description Inhibition of [3H]- DPDPE binding to delta opioid receptor of guinea pig brain				J Med Chem 38: 1242-6 (1995) BindingDB Entry DOI: 10.7270/Q21835J2
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50034243 ((S)-3-((S)-2-{(S)-2-[(S)-2-Amino-3-(4-hydroxy-phen...) Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1c(C)c(C)c(C)c(C)c1C)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(=O)NCC(N)=O Show InChI InChI=1S/C42H62N8O10/c1-19(2)35(41(59)45-18-33(44)52)50-42(60)36(20(3)4)49-40(58)32(17-34(53)54)48-39(57)31(16-29-24(8)22(6)21(5)23(7)25(29)9)47-37(55)26(10)46-38(56)30(43)15-27-11-13-28(51)14-12-27/h11-14,19-20,26,30-32,35-36,51H,15-18,43H2,1-10H3,(H2,44,52)(H,45,59)(H,46,56)(H,47,55)(H,48,57)(H,49,58)(H,50,60)(H,53,54)/t26-,30-,31-,32-,35-,36-/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Eastern Michigan University Curated by ChEMBL					Assay Description Inhibition of [3H]- U 69593 from Opioid receptor kappa 1 of guinea pig brain				J Med Chem 38: 1242-6 (1995) BindingDB Entry DOI: 10.7270/Q21835J2
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50034243 ((S)-3-((S)-2-{(S)-2-[(S)-2-Amino-3-(4-hydroxy-phen...) Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1c(C)c(C)c(C)c(C)c1C)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(=O)NCC(N)=O Show InChI InChI=1S/C42H62N8O10/c1-19(2)35(41(59)45-18-33(44)52)50-42(60)36(20(3)4)49-40(58)32(17-34(53)54)48-39(57)31(16-29-24(8)22(6)21(5)23(7)25(29)9)47-37(55)26(10)46-38(56)30(43)15-27-11-13-28(51)14-12-27/h11-14,19-20,26,30-32,35-36,51H,15-18,43H2,1-10H3,(H2,44,52)(H,45,59)(H,46,56)(H,47,55)(H,48,57)(H,49,58)(H,50,60)(H,53,54)/t26-,30-,31-,32-,35-,36-/m0/s1	UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Eastern Michigan University Curated by ChEMBL					Assay Description Inhibition of [3H]-DAMGO binding to Opioid receptor mu 1 of guinea pig brain				J Med Chem 38: 1242-6 (1995) BindingDB Entry DOI: 10.7270/Q21835J2
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50034243 ((S)-3-((S)-2-{(S)-2-[(S)-2-Amino-3-(4-hydroxy-phen...) Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1c(C)c(C)c(C)c(C)c1C)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(=O)NCC(N)=O Show InChI InChI=1S/C42H62N8O10/c1-19(2)35(41(59)45-18-33(44)52)50-42(60)36(20(3)4)49-40(58)32(17-34(53)54)48-39(57)31(16-29-24(8)22(6)21(5)23(7)25(29)9)47-37(55)26(10)46-38(56)30(43)15-27-11-13-28(51)14-12-27/h11-14,19-20,26,30-32,35-36,51H,15-18,43H2,1-10H3,(H2,44,52)(H,45,59)(H,46,56)(H,47,55)(H,48,57)(H,49,58)(H,50,60)(H,53,54)/t26-,30-,31-,32-,35-,36-/m0/s1	UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Eastern Michigan University Curated by ChEMBL					Assay Description Inhibition of [3H]-DAMGO binding to Opioid receptor mu 1 of guinea pig brain				J Med Chem 38: 1242-6 (1995) BindingDB Entry DOI: 10.7270/Q21835J2
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Cavia porcellus (domestic guinea pig))	BDBM50034243 ((S)-3-((S)-2-{(S)-2-[(S)-2-Amino-3-(4-hydroxy-phen...) Show SMILES CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](Cc1c(C)c(C)c(C)c(C)c1C)NC(=O)[C@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(C)C)C(=O)NCC(N)=O Show InChI InChI=1S/C42H62N8O10/c1-19(2)35(41(59)45-18-33(44)52)50-42(60)36(20(3)4)49-40(58)32(17-34(53)54)48-39(57)31(16-29-24(8)22(6)21(5)23(7)25(29)9)47-37(55)26(10)46-38(56)30(43)15-27-11-13-28(51)14-12-27/h11-14,19-20,26,30-32,35-36,51H,15-18,43H2,1-10H3,(H2,44,52)(H,45,59)(H,46,56)(H,47,55)(H,48,57)(H,49,58)(H,50,60)(H,53,54)/t26-,30-,31-,32-,35-,36-/m0/s1	PDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Eastern Michigan University Curated by ChEMBL					Assay Description Inhibition of [3H]- U 69593 from Opioid receptor kappa 1 of guinea pig brain				J Med Chem 38: 1242-6 (1995) BindingDB Entry DOI: 10.7270/Q21835J2
					More data for this Ligand-Target Pair