BindingDB logo
myBDB logout

null

SMILES: [H][C@@]12Oc3c4c(C[C@@]5([H])N(CC[C@@]14[C@@]5([H])C=C[C@@H]2O)C(C)Cc1ccccc1)ccc3O

InChI Key: InChIKey=HVAYCZHHBZEKLI-MCGXCCNXSA-N

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 2 hits for monomerid = 50497135   
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/Kappa-type/Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50497135
PNG
(CHEMBL3275470)
Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(CC[C@@]14[C@@]5([H])C=C[C@@H]2O)C(C)Cc1ccccc1)ccc3O |r,c:18,THB:19:9:13:4.5.6|
Show InChI InChI=1S/C25H27NO3/c1-15(13-16-5-3-2-4-6-16)26-12-11-25-18-8-10-21(28)24(25)29-23-20(27)9-7-17(22(23)25)14-19(18)26/h2-10,15,18-19,21,24,27-28H,11-14H2,1H3/t15?,18-,19+,21-,24-,25-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 125n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]-naloxone from rat opioid receptor after 30 mins by liquid scintillation counting analysis in presence of NaCl


J Med Chem 21: 415-22 (1978)


Article DOI: 10.1021/jm00203a002
BindingDB Entry DOI: 10.7270/Q2BK1GB7
More data for this
Ligand-Target Pair
Delta-type/Kappa-type/Mu-type opioid receptor


(Rattus norvegicus (rat))
BDBM50497135
PNG
(CHEMBL3275470)
Show SMILES [H][C@@]12Oc3c4c(C[C@@]5([H])N(CC[C@@]14[C@@]5([H])C=C[C@@H]2O)C(C)Cc1ccccc1)ccc3O |r,c:18,THB:19:9:13:4.5.6|
Show InChI InChI=1S/C25H27NO3/c1-15(13-16-5-3-2-4-6-16)26-12-11-25-18-8-10-21(28)24(25)29-23-20(27)9-7-17(22(23)25)14-19(18)26/h2-10,15,18-19,21,24,27-28H,11-14H2,1H3/t15?,18-,19+,21-,24-,25-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.40n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Displacement of [3H]-naloxone from rat opioid receptor after 30 mins by liquid scintillation counting analysis in absence of NaCl


J Med Chem 21: 415-22 (1978)


Article DOI: 10.1021/jm00203a002
BindingDB Entry DOI: 10.7270/Q2BK1GB7
More data for this
Ligand-Target Pair