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SMILES: CCC(=O)N(CCCNC(N)=N)C1CCN(CCc2ccccc2)CC1

InChI Key: InChIKey=WOQPFMCJBFSWRF-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50138433   
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
Mu-type opioid receptor


(Homo sapiens (Human))
BDBM50138433
PNG
(CHEMBL147949 | N-(3-Guanidino-propyl)-N-(1-pheneth...)
Show SMILES CCC(=O)N(CCCNC(N)=N)C1CCN(CCc2ccccc2)CC1
Show InChI InChI=1S/C20H33N5O/c1-2-19(26)25(13-6-12-23-20(21)22)18-10-15-24(16-11-18)14-9-17-7-4-3-5-8-17/h3-5,7-8,18H,2,6,9-16H2,1H3,(H4,21,22,23)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

PubMed
23n/an/an/an/an/an/an/an/a



Instituto de Química Médica

Curated by ChEMBL


Assay Description
Displacement of [3H]-DAMGO (2 nM ) from opioid receptor mu 1 in human brain


Bioorg Med Chem Lett 14: 491-3 (2003)


BindingDB Entry DOI: 10.7270/Q2CR5STS
More data for this
Ligand-Target Pair
Amine oxidase [flavin-containing] A/B


(Homo sapiens (Human))
BDBM50138433
PNG
(CHEMBL147949 | N-(3-Guanidino-propyl)-N-(1-pheneth...)
Show SMILES CCC(=O)N(CCCNC(N)=N)C1CCN(CCc2ccccc2)CC1
Show InChI InChI=1S/C20H33N5O/c1-2-19(26)25(13-6-12-23-20(21)22)18-10-15-24(16-11-18)14-9-17-7-4-3-5-8-17/h3-5,7-8,18H,2,6,9-16H2,1H3,(H4,21,22,23)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
1.92E+3n/an/an/an/an/an/an/an/a



Instituto de Química Médica

Curated by ChEMBL


Assay Description
Displacement of [3H]-2-BFI (1 nM) from imidazoline receptor I-2 in human brain


Bioorg Med Chem Lett 14: 491-3 (2003)


BindingDB Entry DOI: 10.7270/Q2CR5STS
More data for this
Ligand-Target Pair