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BDBM50000198 CHEMBL142967

SMILES: Cn1nccc1-c1ccccc1OCC1=NCCN1

InChI Key: InChIKey=OORBCPFAQRRXTM-UHFFFAOYSA-N

Data: 3 EC50

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 3 hits for monomerid = 50000198   
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-1A adrenergic receptor


(Homo sapiens (Human))
BDBM50000198
PNG
(CHEMBL142967)
Show SMILES Cn1nccc1-c1ccccc1OCC1=NCCN1 |t:16|
Show InChI InChI=1S/C14H16N4O/c1-18-12(6-7-17-18)11-4-2-3-5-13(11)19-10-14-15-8-9-16-14/h2-7H,8-10H2,1H3,(H,15,16)
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KEGG

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/an/an/a 40n/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Activation of recombinant human adrenergic,alpha-1A receptor expressed in rat-1 fibroblasts determined via calcium mobilization through Gq coupled PL...


Bioorg Med Chem Lett 12: 471-5 (2002)

Checked by Author
BindingDB Entry DOI: 10.7270/Q22V2HD6
More data for this
Ligand-Target Pair
Alpha-1D adrenergic receptor


(Homo sapiens (Human))
BDBM50000198
PNG
(CHEMBL142967)
Show SMILES Cn1nccc1-c1ccccc1OCC1=NCCN1 |t:16|
Show InChI InChI=1S/C14H16N4O/c1-18-12(6-7-17-18)11-4-2-3-5-13(11)19-10-14-15-8-9-16-14/h2-7H,8-10H2,1H3,(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<1.00E+5n/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Activation of recombinant human adrenergic, alpha-1D receptor expressed in rat-1 fibroblasts assayed via calcium mobilization through Gq coupled PLC ...


Bioorg Med Chem Lett 12: 471-5 (2002)

Checked by Author
BindingDB Entry DOI: 10.7270/Q22V2HD6
More data for this
Ligand-Target Pair
Alpha-1B adrenergic receptor


(Homo sapiens (Human))
BDBM50000198
PNG
(CHEMBL142967)
Show SMILES Cn1nccc1-c1ccccc1OCC1=NCCN1 |t:16|
Show InChI InChI=1S/C14H16N4O/c1-18-12(6-7-17-18)11-4-2-3-5-13(11)19-10-14-15-8-9-16-14/h2-7H,8-10H2,1H3,(H,15,16)
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/an/an/a<1.00E+5n/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Activation of recombinant human adrenergic, alpha-1B receptor expressed in rat-1 fibroblasts determined via calcium mobilization through Gq coupled P...


Bioorg Med Chem Lett 12: 471-5 (2002)

Checked by Author
BindingDB Entry DOI: 10.7270/Q22V2HD6
More data for this
Ligand-Target Pair