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BDBM50208419 2-{2-hydroxy-5-[(E)-2-(4-hydroxy-phenyl)-vinyl]-benzo[4,5]imidazo[1,2-a]quinolin-1-ylmethyl}-isoindole-1,3-dione::CHEMBL389311

SMILES: Oc1ccc(\C=C\c2cc3nc4ccccc4n3c3c(CN4C(=O)c5ccccc5C4=O)c(O)ccc23)cc1

InChI Key: InChIKey=HPQBLOVWHIIMFO-FMIVXFBMSA-N

Data: 2 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50208419   
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
Cholecystokinin receptor


(RAT)
BDBM50208419
PNG
(2-{2-hydroxy-5-[(E)-2-(4-hydroxy-phenyl)-vinyl]-be...)
Show SMILES Oc1ccc(\C=C\c2cc3nc4ccccc4n3c3c(CN4C(=O)c5ccccc5C4=O)c(O)ccc23)cc1
Show InChI InChI=1S/C32H21N3O4/c36-21-13-10-19(11-14-21)9-12-20-17-29-33-26-7-3-4-8-27(26)35(29)30-22(20)15-16-28(37)25(30)18-34-31(38)23-5-1-2-6-24(23)32(34)39/h1-17,36-37H,18H2/b12-9+
PDB

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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 665n/an/an/an/an/an/a



Lucknow University

Curated by ChEMBL


Assay Description
Displacement of [125I](BH)CCK8 from rat CCK1 after 30 mins by receptor binding assay


Bioorg Med Chem Lett 17: 2749-55 (2007)


Article DOI: 10.1016/j.bmcl.2007.02.071
BindingDB Entry DOI: 10.7270/Q2PV6K16
More data for this
Ligand-Target Pair
Cholecystokinin A receptor


(Cavia porcellus)
BDBM50208419
PNG
(2-{2-hydroxy-5-[(E)-2-(4-hydroxy-phenyl)-vinyl]-be...)
Show SMILES Oc1ccc(\C=C\c2cc3nc4ccccc4n3c3c(CN4C(=O)c5ccccc5C4=O)c(O)ccc23)cc1
Show InChI InChI=1S/C32H21N3O4/c36-21-13-10-19(11-14-21)9-12-20-17-29-33-26-7-3-4-8-27(26)35(29)30-22(20)15-16-28(37)25(30)18-34-31(38)23-5-1-2-6-24(23)32(34)39/h1-17,36-37H,18H2/b12-9+
PDB
MMDB

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B.MOAD
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.94E+3n/an/an/an/an/an/a



Lucknow University

Curated by ChEMBL


Assay Description
Displacement of [125I](BH)CCK8 from Guinea pig CCK1 after 30 mins by receptor binding assay


Bioorg Med Chem Lett 17: 2749-55 (2007)


Article DOI: 10.1016/j.bmcl.2007.02.071
BindingDB Entry DOI: 10.7270/Q2PV6K16
More data for this
Ligand-Target Pair