BDBM50090004 CHEMBL269377::[D-Pro2] Dynorphin A (1-11)-NH2H-Tyr-D-Pro-Gly-Phe-Leu-Arg-Arg-Ile-Arg-Pro-Lys-NH2

SMILES: CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCCCN)C(N)=O

InChI Key: InChIKey=VZFYSSABILOIGC-LKYFVMGBSA-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 = 50090004   

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
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50090004 (CHEMBL269377 | [D-Pro2] Dynorphin A (1-11)-NH2H-Ty...) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCCCN)C(N)=O Show InChI InChI=1S/C66H108N22O12/c1-5-39(4)53(61(98)84-47(21-13-31-78-66(74)75)63(100)88-33-15-23-51(88)60(97)81-44(54(69)91)18-9-10-28-67)86-56(93)46(20-12-30-77-65(72)73)82-55(92)45(19-11-29-76-64(70)71)83-57(94)48(34-38(2)3)85-58(95)49(36-40-16-7-6-8-17-40)80-52(90)37-79-59(96)50-22-14-32-87(50)62(99)43(68)35-41-24-26-42(89)27-25-41/h6-8,16-17,24-27,38-39,43-51,53,89H,5,9-15,18-23,28-37,67-68H2,1-4H3,(H2,69,91)(H,79,96)(H,80,90)(H,81,97)(H,82,92)(H,83,94)(H,84,98)(H,85,95)(H,86,93)(H4,70,71,76)(H4,72,73,77)(H4,74,75,78)/t39-,43-,44-,45-,46-,47-,48-,49-,50-,51+,53-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	65	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Human Opioid receptor kappa 1 mediated stimulation of [35S]- GTPgammaS binding in CHO cells (Agonist potency).				J Med Chem 43: 2698-702 (2000) BindingDB Entry DOI: 10.7270/Q25D8SJ1
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50090004 (CHEMBL269377 | [D-Pro2] Dynorphin A (1-11)-NH2H-Ty...) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCCCN)C(N)=O Show InChI InChI=1S/C66H108N22O12/c1-5-39(4)53(61(98)84-47(21-13-31-78-66(74)75)63(100)88-33-15-23-51(88)60(97)81-44(54(69)91)18-9-10-28-67)86-56(93)46(20-12-30-77-65(72)73)82-55(92)45(19-11-29-76-64(70)71)83-57(94)48(34-38(2)3)85-58(95)49(36-40-16-7-6-8-17-40)80-52(90)37-79-59(96)50-22-14-32-87(50)62(99)43(68)35-41-24-26-42(89)27-25-41/h6-8,16-17,24-27,38-39,43-51,53,89H,5,9-15,18-23,28-37,67-68H2,1-4H3,(H2,69,91)(H,79,96)(H,80,90)(H,81,97)(H,82,92)(H,83,94)(H,84,98)(H,85,95)(H,86,93)(H4,70,71,76)(H4,72,73,77)(H4,74,75,78)/t39-,43-,44-,45-,46-,47-,48-,49-,50-,51+,53-/m0/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Binding affinity towards cloned human Opioid receptor mu 1 in CHO cell membranes.				J Med Chem 43: 2698-702 (2000) BindingDB Entry DOI: 10.7270/Q25D8SJ1
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50090004 (CHEMBL269377 | [D-Pro2] Dynorphin A (1-11)-NH2H-Ty...) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)Cc1ccc(O)cc1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CCCCN)C(N)=O Show InChI InChI=1S/C66H108N22O12/c1-5-39(4)53(61(98)84-47(21-13-31-78-66(74)75)63(100)88-33-15-23-51(88)60(97)81-44(54(69)91)18-9-10-28-67)86-56(93)46(20-12-30-77-65(72)73)82-55(92)45(19-11-29-76-64(70)71)83-57(94)48(34-38(2)3)85-58(95)49(36-40-16-7-6-8-17-40)80-52(90)37-79-59(96)50-22-14-32-87(50)62(99)43(68)35-41-24-26-42(89)27-25-41/h6-8,16-17,24-27,38-39,43-51,53,89H,5,9-15,18-23,28-37,67-68H2,1-4H3,(H2,69,91)(H,79,96)(H,80,90)(H,81,97)(H,82,92)(H,83,94)(H,84,98)(H,85,95)(H,86,93)(H4,70,71,76)(H4,72,73,77)(H4,74,75,78)/t39-,43-,44-,45-,46-,47-,48-,49-,50-,51+,53-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.90E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of California Curated by ChEMBL					Assay Description Binding affinity towards cloned human Opioid receptor delta 1 in CHO cell membranes.				J Med Chem 43: 2698-702 (2000) BindingDB Entry DOI: 10.7270/Q25D8SJ1
					More data for this Ligand-Target Pair