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SMILES: N[C@@H](Cc1ccc(O)cc1)C(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](CC(O)=O)C(N)=O

InChI Key: InChIKey=NUGMDXLERDNCRM-MNKIWLFQSA-N

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50095745   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Delta-type opioid receptor


(Homo sapiens (Human))
BDBM50095745
PNG
(4-[2-({2-[2-Amino-3-(4-hydroxy-phenyl)-propionyl]-...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](CC(O)=O)C(N)=O
Show InChI InChI=1S/C33H37N5O7/c34-25(16-21-10-12-24(39)13-11-21)33(45)38-19-23-9-5-4-8-22(23)18-28(38)32(44)37-27(17-20-6-2-1-3-7-20)31(43)36-26(30(35)42)14-15-29(40)41/h1-13,25-28,39H,14-19,34H2,(H2,35,42)(H,36,43)(H,37,44)(H,40,41)/t25?,26-,27?,28?/m1/s1
PDB

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CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
10n/an/an/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Affinity towards human Opioid receptor delta 1 on CHO cell membranes using [3H]DPDPE displacement.


J Med Chem 43: 5050-4 (2001)


BindingDB Entry DOI: 10.7270/Q20P0Z8P
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50095745
PNG
(4-[2-({2-[2-Amino-3-(4-hydroxy-phenyl)-propionyl]-...)
Show SMILES N[C@@H](Cc1ccc(O)cc1)C(=O)N1Cc2ccccc2C[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](CC(O)=O)C(N)=O
Show InChI InChI=1S/C33H37N5O7/c34-25(16-21-10-12-24(39)13-11-21)33(45)38-19-23-9-5-4-8-22(23)18-28(38)32(44)37-27(17-20-6-2-1-3-7-20)31(43)36-26(30(35)42)14-15-29(40)41/h1-13,25-28,39H,14-19,34H2,(H2,35,42)(H,36,43)(H,37,44)(H,40,41)/t25?,26-,27?,28?/m1/s1
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
3.28E+3n/an/an/an/an/an/an/an/a



University of Maryland

Curated by ChEMBL


Assay Description
Affinity towards human Opioid receptor mu 1 on CHO cell membranes using [3H]DAMGO displacement.


J Med Chem 43: 5050-4 (2001)


BindingDB Entry DOI: 10.7270/Q20P0Z8P
More data for this
Ligand-Target Pair