null

SMILES: C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CCC(=O)NCCCCCC(=O)N(C1CCN(CCc2ccccc2)CC1)c1ccccc1)C(=O)N[C@@H](Cc1c(F)c(F)c(F)c(F)c1F)C(N)=O

InChI Key: InChIKey=INQWRMKPKQZIOZ-HOZBKMJVSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50491869   

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 (Rattus norvegicus (rat))	BDBM50491869 (CHEMBL2387328) Show SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CCC(=O)NCCCCCC(=O)N(C1CCN(CCc2ccccc2)CC1)c1ccccc1)C(=O)N[C@@H](Cc1c(F)c(F)c(F)c(F)c1F)C(N)=O |r| Show InChI InChI=1S/C62H72ClF5N10O9/c1-37(73-60(85)46(69)33-39-18-22-44(79)23-19-39)59(84)72-36-51(81)74-49(34-40-16-20-41(63)21-17-40)62(87)75-47(61(86)76-48(58(70)83)35-45-53(64)55(66)57(68)56(67)54(45)65)24-25-50(80)71-29-10-4-9-15-52(82)78(42-13-7-3-8-14-42)43-27-31-77(32-28-43)30-26-38-11-5-2-6-12-38/h2-3,5-8,11-14,16-23,37,43,46-49,79H,4,9-10,15,24-36,69H2,1H3,(H2,70,83)(H,71,80)(H,72,84)(H,73,85)(H,74,81)(H,75,87)(H,76,86)/t37-,46+,47+,48+,49+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	0.280	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Displacement of [3H]DAMGO from rat mu opioid receptor expressed in mouse HN9.10 cell membranes				Bioorg Med Chem Lett 23: 3434-7 (2013) Article DOI: 10.1016/j.bmcl.2013.03.065 BindingDB Entry DOI: 10.7270/Q2T72MCM
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50491869 (CHEMBL2387328) Show SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CCC(=O)NCCCCCC(=O)N(C1CCN(CCc2ccccc2)CC1)c1ccccc1)C(=O)N[C@@H](Cc1c(F)c(F)c(F)c(F)c1F)C(N)=O |r| Show InChI InChI=1S/C62H72ClF5N10O9/c1-37(73-60(85)46(69)33-39-18-22-44(79)23-19-39)59(84)72-36-51(81)74-49(34-40-16-20-41(63)21-17-40)62(87)75-47(61(86)76-48(58(70)83)35-45-53(64)55(66)57(68)56(67)54(45)65)24-25-50(80)71-29-10-4-9-15-52(82)78(42-13-7-3-8-14-42)43-27-31-77(32-28-43)30-26-38-11-5-2-6-12-38/h2-3,5-8,11-14,16-23,37,43,46-49,79H,4,9-10,15,24-36,69H2,1H3,(H2,70,83)(H,71,80)(H,72,84)(H,73,85)(H,74,81)(H,75,87)(H,76,86)/t37-,46+,47+,48+,49+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	0.510	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Displacement of [3H]DPDPE from human delta opioid receptor expressed in mouse HN9.10 cell membranes				Bioorg Med Chem Lett 23: 3434-7 (2013) Article DOI: 10.1016/j.bmcl.2013.03.065 BindingDB Entry DOI: 10.7270/Q2T72MCM
					More data for this Ligand-Target Pair
Delta-type opioid receptor (MOUSE)	BDBM50491869 (CHEMBL2387328) Show SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CCC(=O)NCCCCCC(=O)N(C1CCN(CCc2ccccc2)CC1)c1ccccc1)C(=O)N[C@@H](Cc1c(F)c(F)c(F)c(F)c1F)C(N)=O |r| Show InChI InChI=1S/C62H72ClF5N10O9/c1-37(73-60(85)46(69)33-39-18-22-44(79)23-19-39)59(84)72-36-51(81)74-49(34-40-16-20-41(63)21-17-40)62(87)75-47(61(86)76-48(58(70)83)35-45-53(64)55(66)57(68)56(67)54(45)65)24-25-50(80)71-29-10-4-9-15-52(82)78(42-13-7-3-8-14-42)43-27-31-77(32-28-43)30-26-38-11-5-2-6-12-38/h2-3,5-8,11-14,16-23,37,43,46-49,79H,4,9-10,15,24-36,69H2,1H3,(H2,70,83)(H,71,80)(H,72,84)(H,73,85)(H,74,81)(H,75,87)(H,76,86)/t37-,46+,47+,48+,49+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.80	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Inhibition of delta opioid receptor in mouse vas deferens assessed as inhibition of electrically-stimulated muscle contraction				Bioorg Med Chem Lett 23: 3434-7 (2013) Article DOI: 10.1016/j.bmcl.2013.03.065 BindingDB Entry DOI: 10.7270/Q2T72MCM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (GUINEA PIG)	BDBM50491869 (CHEMBL2387328) Show SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CCC(=O)NCCCCCC(=O)N(C1CCN(CCc2ccccc2)CC1)c1ccccc1)C(=O)N[C@@H](Cc1c(F)c(F)c(F)c(F)c1F)C(N)=O |r| Show InChI InChI=1S/C62H72ClF5N10O9/c1-37(73-60(85)46(69)33-39-18-22-44(79)23-19-39)59(84)72-36-51(81)74-49(34-40-16-20-41(63)21-17-40)62(87)75-47(61(86)76-48(58(70)83)35-45-53(64)55(66)57(68)56(67)54(45)65)24-25-50(80)71-29-10-4-9-15-52(82)78(42-13-7-3-8-14-42)43-27-31-77(32-28-43)30-26-38-11-5-2-6-12-38/h2-3,5-8,11-14,16-23,37,43,46-49,79H,4,9-10,15,24-36,69H2,1H3,(H2,70,83)(H,71,80)(H,72,84)(H,73,85)(H,74,81)(H,75,87)(H,76,86)/t37-,46+,47+,48+,49+/m1/s1	UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	67	n/a	n/a	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Inhibition of mu opioid receptor in guinea pig ileum/longitudinal muscle with myenteric plexus assessed as inhibition of electrically-stimulated musc...				Bioorg Med Chem Lett 23: 3434-7 (2013) Article DOI: 10.1016/j.bmcl.2013.03.065 BindingDB Entry DOI: 10.7270/Q2T72MCM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50491869 (CHEMBL2387328) Show SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CCC(=O)NCCCCCC(=O)N(C1CCN(CCc2ccccc2)CC1)c1ccccc1)C(=O)N[C@@H](Cc1c(F)c(F)c(F)c(F)c1F)C(N)=O |r| Show InChI InChI=1S/C62H72ClF5N10O9/c1-37(73-60(85)46(69)33-39-18-22-44(79)23-19-39)59(84)72-36-51(81)74-49(34-40-16-20-41(63)21-17-40)62(87)75-47(61(86)76-48(58(70)83)35-45-53(64)55(66)57(68)56(67)54(45)65)24-25-50(80)71-29-10-4-9-15-52(82)78(42-13-7-3-8-14-42)43-27-31-77(32-28-43)30-26-38-11-5-2-6-12-38/h2-3,5-8,11-14,16-23,37,43,46-49,79H,4,9-10,15,24-36,69H2,1H3,(H2,70,83)(H,71,80)(H,72,84)(H,73,85)(H,74,81)(H,75,87)(H,76,86)/t37-,46+,47+,48+,49+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.20	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Agonist activity at rat mu opioid receptor expressed in CHO cells by [35S]GTP-gamma-S binding assay				Bioorg Med Chem Lett 23: 3434-7 (2013) Article DOI: 10.1016/j.bmcl.2013.03.065 BindingDB Entry DOI: 10.7270/Q2T72MCM
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50491869 (CHEMBL2387328) Show SMILES C[C@@H](NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)NCC(=O)N[C@@H](Cc1ccc(Cl)cc1)C(=O)N[C@@H](CCC(=O)NCCCCCC(=O)N(C1CCN(CCc2ccccc2)CC1)c1ccccc1)C(=O)N[C@@H](Cc1c(F)c(F)c(F)c(F)c1F)C(N)=O |r| Show InChI InChI=1S/C62H72ClF5N10O9/c1-37(73-60(85)46(69)33-39-18-22-44(79)23-19-39)59(84)72-36-51(81)74-49(34-40-16-20-41(63)21-17-40)62(87)75-47(61(86)76-48(58(70)83)35-45-53(64)55(66)57(68)56(67)54(45)65)24-25-50(80)71-29-10-4-9-15-52(82)78(42-13-7-3-8-14-42)43-27-31-77(32-28-43)30-26-38-11-5-2-6-12-38/h2-3,5-8,11-14,16-23,37,43,46-49,79H,4,9-10,15,24-36,69H2,1H3,(H2,70,83)(H,71,80)(H,72,84)(H,73,85)(H,74,81)(H,75,87)(H,76,86)/t37-,46+,47+,48+,49+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.10	n/a	n/a	n/a	n/a
University of Arizona Curated by ChEMBL					Assay Description Agonist activity at human delta opioid receptor expressed in CHO cells by [35S]GTP-gamma-S binding assay				Bioorg Med Chem Lett 23: 3434-7 (2013) Article DOI: 10.1016/j.bmcl.2013.03.065 BindingDB Entry DOI: 10.7270/Q2T72MCM
					More data for this Ligand-Target Pair