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SMILES: O=C1CCc2ccccc2N1OCCN1CCC(CC1)n1c2ccccc2[nH]c1=O

InChI Key: InChIKey=ZXXQVMFRALHHSH-UHFFFAOYSA-N

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 = 50388665   
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
D(2) dopamine receptor


(Homo sapiens (Human))
BDBM50388665
PNG
(CHEMBL2059312)
Show SMILES O=C1CCc2ccccc2N1OCCN1CCC(CC1)n1c2ccccc2[nH]c1=O
Show InChI InChI=1S/C23H26N4O3/c28-22-10-9-17-5-1-3-7-20(17)27(22)30-16-15-25-13-11-18(12-14-25)26-21-8-4-2-6-19(21)24-23(26)29/h1-8,18H,9-16H2,(H,24,29)
PDB

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PC cid
PC sid
UniChem
Article
PubMed
55n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Displacement of [3H]raclopride from human D2L receptor expressed in CHO cells after 60 mins by scintillation proximity assay


Bioorg Med Chem Lett 22: 5134-40 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.048
BindingDB Entry DOI: 10.7270/Q24M95MM
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2


(Homo sapiens (Human))
BDBM50388665
PNG
(CHEMBL2059312)
Show SMILES O=C1CCc2ccccc2N1OCCN1CCC(CC1)n1c2ccccc2[nH]c1=O
Show InChI InChI=1S/C23H26N4O3/c28-22-10-9-17-5-1-3-7-20(17)27(22)30-16-15-25-13-11-18(12-14-25)26-21-8-4-2-6-19(21)24-23(26)29/h1-8,18H,9-16H2,(H,24,29)
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 9.30E+3n/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Inhibition of human ERG expressed in CHO cells after 30 mins by Rb+ flux assay


Bioorg Med Chem Lett 22: 5134-40 (2012)


Article DOI: 10.1016/j.bmcl.2012.05.048
BindingDB Entry DOI: 10.7270/Q24M95MM
More data for this
Ligand-Target Pair