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BDBM50237685 CHEMBL4099311

SMILES: O=C(N1CCCCC1)C1=C(Nc2ccccc2)O\C(=C/c2c[nH]c3ncccc23)C1=O

InChI Key: InChIKey=BIVQAKMJEHVJCF-RGEXLXHISA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50237685   
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
CDC7 and DBF4


(Homo sapiens (Human))
BDBM50237685
PNG
(CHEMBL4099311)
Show SMILES O=C(N1CCCCC1)C1=C(Nc2ccccc2)O\C(=C/c2c[nH]c3ncccc23)C1=O |c:9|
Show InChI InChI=1S/C24H22N4O3/c29-21-19(14-16-15-26-22-18(16)10-7-11-25-22)31-23(27-17-8-3-1-4-9-17)20(21)24(30)28-12-5-2-6-13-28/h1,3-4,7-11,14-15,27H,2,5-6,12-13H2,(H,25,26)/b19-14-
PDB

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UniProtKB/TrEMBL

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PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 890n/an/an/an/an/an/a



Carna Biosciences, Inc.

Curated by ChEMBL


Assay Description
Inhibition of [3H]AVP binding to recombinant human vasopressin V1a receptor


Eur J Med Chem 130: 406-418 (2017)


Article DOI: 10.1016/j.ejmech.2017.02.030
BindingDB Entry DOI: 10.7270/Q2X63Q71
More data for this
Ligand-Target Pair