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3 similar compounds to monomer 50098334

Compile data set for download or QSAR
Wt: 243.1
BDBM50370023
Wt: 322.0
BDBM50370036
Wt: 336.0
BDBM50370047

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50370023,50370036,50370047   
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-1D adrenergic receptor


(Homo sapiens (Human))
BDBM50370036
PNG
(CHEMBL1203855)
Show SMILES Brc1csc(Cc2cnc[nH]2)c1Br
Show InChI InChI=1S/C8H6Br2N2S/c9-6-3-13-7(8(6)10)1-5-2-11-4-12-5/h2-4H,1H2,(H,11,12)
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UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.0700n/an/an/an/an/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
In vitro binding affinity against alpha-2D adrenergic receptor of male Wistar rat


J Med Chem 44: 863-72 (2001)


Article DOI: 10.1021/jm0003891
BindingDB Entry DOI: 10.7270/Q23R0TKP
More data for this
Ligand-Target Pair
Alpha-1D adrenergic receptor


(Homo sapiens (Human))
BDBM50370023
PNG
(CHEMBL1203850)
Show SMILES Brc1ccsc1Cc1cnc[nH]1
Show InChI InChI=1S/C8H7BrN2S/c9-7-1-2-12-8(7)3-6-4-10-5-11-6/h1-2,4-5H,3H2,(H,10,11)
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KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.350n/an/an/an/an/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
In vitro binding affinity against alpha-2D adrenergic receptor of male Wistar rat


J Med Chem 44: 863-72 (2001)


Article DOI: 10.1021/jm0003891
BindingDB Entry DOI: 10.7270/Q23R0TKP
More data for this
Ligand-Target Pair
Alpha-1D adrenergic receptor


(Homo sapiens (Human))
BDBM50370047
PNG
(CHEMBL1744280)
Show SMILES CC(c1cnc[nH]1)c1scc(Br)c1Br
Show InChI InChI=1S/C9H8Br2N2S/c1-5(7-2-12-4-13-7)9-8(11)6(10)3-14-9/h2-5H,1H3,(H,12,13)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
0.430n/an/an/an/an/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
In vitro binding affinity against alpha-2D adrenergic receptor of male Wistar rat


J Med Chem 44: 863-72 (2001)


Article DOI: 10.1021/jm0003891
BindingDB Entry DOI: 10.7270/Q23R0TKP
More data for this
Ligand-Target Pair