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BDBM150229 US8980906, 31

SMILES: COc1ccc2C[C@H]3N(Cc4ccccc4)CC[C@@]4(Cc5[nH]c(=O)c(cc5C[C@@]34O)C(N)=O)c2c1

InChI Key:

Data: 2 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 2 hits for monomerid = 150229   
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
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM150229
PNG
(US8980906, 31)
Show SMILES COc1ccc2C[C@H]3N(Cc4ccccc4)CC[C@@]4(Cc5[nH]c(=O)c(cc5C[C@@]34O)C(N)=O)c2c1 |r|
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

US Patent
1.58E+3n/an/an/an/an/an/a7.4n/a



Purdue Pharma L.P.

US Patent


Assay Description
Radioligand dose displacement assays used 0.4 nM [3H]-U69,593 (GE Healthcare, Piscataway, N.J.; 40 Ci/mmole) with 15 μg membrane protein (recomb...


US Patent US8980906 (2015)


BindingDB Entry DOI: 10.7270/Q2W37V15
More data for this
Ligand-Target Pair
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM150229
PNG
(US8980906, 31)
Show SMILES COc1ccc2C[C@H]3N(Cc4ccccc4)CC[C@@]4(Cc5[nH]c(=O)c(cc5C[C@@]34O)C(N)=O)c2c1 |r|
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

US Patent
5.59E+3 -7.76n/an/an/an/an/a7.450



Purdue Pharma L.P.

US Patent


Assay Description
Radioligand dose-displacement binding assays for mu-opioid receptors used 0.3 nM [3H]-diprenorphine (Perkin Elmer, Shelton, Conn.), with 5 mg membran...


US Patent US8980906 (2015)


BindingDB Entry DOI: 10.7270/Q2W37V15
More data for this
Ligand-Target Pair