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BDBM50412255 CHEMBL492444

SMILES: C1CN=C(N1)C1COc2cc(ccc2O1)-c1ccccc1

InChI Key: InChIKey=MOEPMTDKDUFBNH-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50412255   
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-2A adrenergic receptor


(Homo sapiens (Human))
BDBM50412255
PNG
(CHEMBL492444)
Show SMILES C1CN=C(N1)C1COc2cc(ccc2O1)-c1ccccc1
Show InChI InChI=1S/C17H16N2O2/c1-2-4-12(5-3-1)13-6-7-14-15(10-13)20-11-16(21-14)17-18-8-9-19-17/h1-7,10,16H,8-9,11H2,(H,18,19)
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antibodypedia
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Similars

Article
PubMed
282n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Camerino

Curated by ChEMBL


Assay Description
Displacement of [3H]RS79948-197 from human recombinant adrenergic alpha2A receptor expressed in CHO cells


J Med Chem 51: 4289-99 (2008)


Article DOI: 10.1021/jm800250z
BindingDB Entry DOI: 10.7270/Q2HQ4147
More data for this
Ligand-Target Pair
Alpha-2C adrenergic receptor


(Homo sapiens (Human))
BDBM50412255
PNG
(CHEMBL492444)
Show SMILES C1CN=C(N1)C1COc2cc(ccc2O1)-c1ccccc1
Show InChI InChI=1S/C17H16N2O2/c1-2-4-12(5-3-1)13-6-7-14-15(10-13)20-11-16(21-14)17-18-8-9-19-17/h1-7,10,16H,8-9,11H2,(H,18,19)
PDB

Reactome pathway

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.59E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Camerino

Curated by ChEMBL


Assay Description
Displacement of [3H]RS79948-197 from human recombinant adrenergic Alpha-2C receptor expressed in CHO cells


J Med Chem 51: 4289-99 (2008)


Article DOI: 10.1021/jm800250z
BindingDB Entry DOI: 10.7270/Q2HQ4147
More data for this
Ligand-Target Pair
Alpha-2B adrenergic receptor


(Homo sapiens (Human))
BDBM50412255
PNG
(CHEMBL492444)
Show SMILES C1CN=C(N1)C1COc2cc(ccc2O1)-c1ccccc1
Show InChI InChI=1S/C17H16N2O2/c1-2-4-12(5-3-1)13-6-7-14-15(10-13)20-11-16(21-14)17-18-8-9-19-17/h1-7,10,16H,8-9,11H2,(H,18,19)
PDB

Reactome pathway

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.66E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Camerino

Curated by ChEMBL


Assay Description
Displacement of [3H]RS79948-197 from human recombinant adrenergic alpha2B receptor expressed in CHO cells


J Med Chem 51: 4289-99 (2008)


Article DOI: 10.1021/jm800250z
BindingDB Entry DOI: 10.7270/Q2HQ4147
More data for this
Ligand-Target Pair