null

SMILES: CC(C)C[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCNC(=O)NCCC(=O)N(C1CCN(CCc2ccccc2)CC1)c1ccccc1)C(O)=O

InChI Key: InChIKey=HKYFTGIURHUTRW-LGXZQHJQSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50491857   

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))	BDBM50491857 (CHEMBL2387213) Show SMILES CC(C)C[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCNC(=O)NCCC(=O)N(C1CCN(CCc2ccccc2)CC1)c1ccccc1)C(O)=O |r| Show InChI InChI=1S/C64H90N14O11/c1-42(2)38-53(76-61(86)54(40-45-18-9-5-10-19-45)73-55(80)41-71-57(82)43(3)72-58(83)50(65)39-46-24-26-49(79)27-25-46)60(85)74-51(23-15-33-68-63(66)67)59(84)75-52(62(87)88)22-13-14-32-69-64(89)70-34-28-56(81)78(47-20-11-6-12-21-47)48-30-36-77(37-31-48)35-29-44-16-7-4-8-17-44/h4-12,16-21,24-27,42-43,48,50-54,79H,13-15,22-23,28-41,65H2,1-3H3,(H,71,82)(H,72,83)(H,73,80)(H,74,85)(H,75,84)(H,76,86)(H,87,88)(H4,66,67,68)(H2,69,70,89)/t43-,50+,51+,52+,53-,54+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	0.350	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))	BDBM50491857 (CHEMBL2387213) Show SMILES CC(C)C[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCNC(=O)NCCC(=O)N(C1CCN(CCc2ccccc2)CC1)c1ccccc1)C(O)=O |r| Show InChI InChI=1S/C64H90N14O11/c1-42(2)38-53(76-61(86)54(40-45-18-9-5-10-19-45)73-55(80)41-71-57(82)43(3)72-58(83)50(65)39-46-24-26-49(79)27-25-46)60(85)74-51(23-15-33-68-63(66)67)59(84)75-52(62(87)88)22-13-14-32-69-64(89)70-34-28-56(81)78(47-20-11-6-12-21-47)48-30-36-77(37-31-48)35-29-44-16-7-4-8-17-44/h4-12,16-21,24-27,42-43,48,50-54,79H,13-15,22-23,28-41,65H2,1-3H3,(H,71,82)(H,72,83)(H,73,80)(H,74,85)(H,75,84)(H,76,86)(H,87,88)(H4,66,67,68)(H2,69,70,89)/t43-,50+,51+,52+,53-,54+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	11	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
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50491857 (CHEMBL2387213) Show SMILES CC(C)C[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCNC(=O)NCCC(=O)N(C1CCN(CCc2ccccc2)CC1)c1ccccc1)C(O)=O |r| Show InChI InChI=1S/C64H90N14O11/c1-42(2)38-53(76-61(86)54(40-45-18-9-5-10-19-45)73-55(80)41-71-57(82)43(3)72-58(83)50(65)39-46-24-26-49(79)27-25-46)60(85)74-51(23-15-33-68-63(66)67)59(84)75-52(62(87)88)22-13-14-32-69-64(89)70-34-28-56(81)78(47-20-11-6-12-21-47)48-30-36-77(37-31-48)35-29-44-16-7-4-8-17-44/h4-12,16-21,24-27,42-43,48,50-54,79H,13-15,22-23,28-41,65H2,1-3H3,(H,71,82)(H,72,83)(H,73,80)(H,74,85)(H,75,84)(H,76,86)(H,87,88)(H4,66,67,68)(H2,69,70,89)/t43-,50+,51+,52+,53-,54+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.80	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 (MOUSE)	BDBM50491857 (CHEMBL2387213) Show SMILES CC(C)C[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCNC(=O)NCCC(=O)N(C1CCN(CCc2ccccc2)CC1)c1ccccc1)C(O)=O |r| Show InChI InChI=1S/C64H90N14O11/c1-42(2)38-53(76-61(86)54(40-45-18-9-5-10-19-45)73-55(80)41-71-57(82)43(3)72-58(83)50(65)39-46-24-26-49(79)27-25-46)60(85)74-51(23-15-33-68-63(66)67)59(84)75-52(62(87)88)22-13-14-32-69-64(89)70-34-28-56(81)78(47-20-11-6-12-21-47)48-30-36-77(37-31-48)35-29-44-16-7-4-8-17-44/h4-12,16-21,24-27,42-43,48,50-54,79H,13-15,22-23,28-41,65H2,1-3H3,(H,71,82)(H,72,83)(H,73,80)(H,74,85)(H,75,84)(H,76,86)(H,87,88)(H4,66,67,68)(H2,69,70,89)/t43-,50+,51+,52+,53-,54+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.60	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
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50491857 (CHEMBL2387213) Show SMILES CC(C)C[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCNC(=O)NCCC(=O)N(C1CCN(CCc2ccccc2)CC1)c1ccccc1)C(O)=O |r| Show InChI InChI=1S/C64H90N14O11/c1-42(2)38-53(76-61(86)54(40-45-18-9-5-10-19-45)73-55(80)41-71-57(82)43(3)72-58(83)50(65)39-46-24-26-49(79)27-25-46)60(85)74-51(23-15-33-68-63(66)67)59(84)75-52(62(87)88)22-13-14-32-69-64(89)70-34-28-56(81)78(47-20-11-6-12-21-47)48-30-36-77(37-31-48)35-29-44-16-7-4-8-17-44/h4-12,16-21,24-27,42-43,48,50-54,79H,13-15,22-23,28-41,65H2,1-3H3,(H,71,82)(H,72,83)(H,73,80)(H,74,85)(H,75,84)(H,76,86)(H,87,88)(H4,66,67,68)(H2,69,70,89)/t43-,50+,51+,52+,53-,54+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	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 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
Mu-type opioid receptor (GUINEA PIG)	BDBM50491857 (CHEMBL2387213) Show SMILES CC(C)C[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCNC(=O)NCCC(=O)N(C1CCN(CCc2ccccc2)CC1)c1ccccc1)C(O)=O |r| Show InChI InChI=1S/C64H90N14O11/c1-42(2)38-53(76-61(86)54(40-45-18-9-5-10-19-45)73-55(80)41-71-57(82)43(3)72-58(83)50(65)39-46-24-26-49(79)27-25-46)60(85)74-51(23-15-33-68-63(66)67)59(84)75-52(62(87)88)22-13-14-32-69-64(89)70-34-28-56(81)78(47-20-11-6-12-21-47)48-30-36-77(37-31-48)35-29-44-16-7-4-8-17-44/h4-12,16-21,24-27,42-43,48,50-54,79H,13-15,22-23,28-41,65H2,1-3H3,(H,71,82)(H,72,83)(H,73,80)(H,74,85)(H,75,84)(H,76,86)(H,87,88)(H4,66,67,68)(H2,69,70,89)/t43-,50+,51+,52+,53-,54+/m1/s1	UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	98	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