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BDBM50222908 CHEMBL273316

SMILES: CCn1ncnc1-c1ccccc1NCC1=NCCN1

InChI Key: InChIKey=KJZVGIURRPLUKJ-UHFFFAOYSA-N

Data: 3 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50222908   
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
Alpha adrenergic receptor (1a and 1d)


(Homo sapiens (Human))
BDBM50222908
PNG
(CHEMBL273316)
Show SMILES CCn1ncnc1-c1ccccc1NCC1=NCCN1 |t:17|
Show InChI InChI=1S/C14H18N6/c1-2-20-14(18-10-19-20)11-5-3-4-6-12(11)17-9-13-15-7-8-16-13/h3-6,10,17H,2,7-9H2,1H3,(H,15,16)
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/an/an/a 126n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonism of recombinant human alpha-1D adrenergic receptor, expressed in rat 1 fibroblast cells


Bioorg Med Chem Lett 13: 1183-6 (2003)


BindingDB Entry DOI: 10.7270/Q21V5G8T
More data for this
Ligand-Target Pair
Alpha-1A adrenergic receptor


(Homo sapiens (Human))
BDBM50222908
PNG
(CHEMBL273316)
Show SMILES CCn1ncnc1-c1ccccc1NCC1=NCCN1 |t:17|
Show InChI InChI=1S/C14H18N6/c1-2-20-14(18-10-19-20)11-5-3-4-6-12(11)17-9-13-15-7-8-16-13/h3-6,10,17H,2,7-9H2,1H3,(H,15,16)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/an/an/a 1.30n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonism of human alpha-1A adrenergic receptor expressed in rat 1 fibroblast cells


Bioorg Med Chem Lett 13: 1183-6 (2003)


BindingDB Entry DOI: 10.7270/Q21V5G8T
More data for this
Ligand-Target Pair
Adrenergic receptor alpha


(Homo sapiens (Human))
BDBM50222908
PNG
(CHEMBL273316)
Show SMILES CCn1ncnc1-c1ccccc1NCC1=NCCN1 |t:17|
Show InChI InChI=1S/C14H18N6/c1-2-20-14(18-10-19-20)11-5-3-4-6-12(11)17-9-13-15-7-8-16-13/h3-6,10,17H,2,7-9H2,1H3,(H,15,16)
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/an/an/a 63n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonism of human alpha-1B adrenergic receptor, expressed in rat 1 fibroblast cells


Bioorg Med Chem Lett 13: 1183-6 (2003)


BindingDB Entry DOI: 10.7270/Q21V5G8T
More data for this
Ligand-Target Pair