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BDBM50426625 CHEMBL2325931

SMILES: CN1CCC(CC1)c1cn(-c2ccncc2)c2ccc(cc12)-c1ccncc1

InChI Key: InChIKey=IRZPPSVFNZCDTA-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50426625   
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
Cerebral cortex alpha adrenergic receptor


(CALF)
BDBM50426625
PNG
(CHEMBL2325931)
Show SMILES CN1CCC(CC1)c1cn(-c2ccncc2)c2ccc(cc12)-c1ccncc1
Show InChI InChI=1S/C24H24N4/c1-27-14-8-19(9-15-27)23-17-28(21-6-12-26-13-7-21)24-3-2-20(16-22(23)24)18-4-10-25-11-5-18/h2-7,10-13,16-17,19H,8-9,14-15H2,1H3
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
24n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Displacement of [3H]prazosine from bovine alpha1A adrenoceptor expressed in BHK cells after 20 mins by scintillation counting analysis


Bioorg Med Chem 21: 196-204 (2012)


Article DOI: 10.1016/j.bmc.2012.10.049
BindingDB Entry DOI: 10.7270/Q2K938VN
More data for this
Ligand-Target Pair
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50426625
PNG
(CHEMBL2325931)
Show SMILES CN1CCC(CC1)c1cn(-c2ccncc2)c2ccc(cc12)-c1ccncc1
Show InChI InChI=1S/C24H24N4/c1-27-14-8-19(9-15-27)23-17-28(21-6-12-26-13-7-21)24-3-2-20(16-22(23)24)18-4-10-25-11-5-18/h2-7,10-13,16-17,19H,8-9,14-15H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
260n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Displacement of [3H]spiperone from human dopamine D2 receptor expressed in CHO cells after 30 mins by scintillation counting analysis


Bioorg Med Chem 21: 196-204 (2012)


Article DOI: 10.1016/j.bmc.2012.10.049
BindingDB Entry DOI: 10.7270/Q2K938VN
More data for this
Ligand-Target Pair