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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 50048741   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50048741
PNG
(2-[5-(8-Aza-spiro[4.5]dec-8-yl)-4-(3,5-dichloro-be...)
Show SMILES OC(=O)c1ccccc1NC(=O)CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCC2(CCCC2)CC1
Show InChI InChI=1S/C28H31Cl2N3O5/c29-19-15-18(16-20(30)17-19)25(35)32-23(26(36)33-13-11-28(12-14-33)9-3-4-10-28)7-8-24(34)31-22-6-2-1-5-21(22)27(37)38/h1-2,5-6,15-17,23H,3-4,7-14H2,(H,31,34)(H,32,35)(H,37,38)
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PC cid
PC sid
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Article
PubMed
n/an/a 55n/an/an/an/an/an/a



Rotta Research Laboratorium

Curated by ChEMBL


Assay Description
In vitro inhibition of gastrin-induced [Ca2+] cytosolic elevation in isolated rabbit parietal cells


J Med Chem 39: 135-42 (1996)


Article DOI: 10.1021/jm950372w
BindingDB Entry DOI: 10.7270/Q2BZ66P3
More data for this
Ligand-Target Pair
Gastrin/cholecystokinin type B receptor


(Homo sapiens (Human))
BDBM50048741
PNG
(2-[5-(8-Aza-spiro[4.5]dec-8-yl)-4-(3,5-dichloro-be...)
Show SMILES OC(=O)c1ccccc1NC(=O)CCC(NC(=O)c1cc(Cl)cc(Cl)c1)C(=O)N1CCC2(CCCC2)CC1
Show InChI InChI=1S/C28H31Cl2N3O5/c29-19-15-18(16-20(30)17-19)25(35)32-23(26(36)33-13-11-28(12-14-33)9-3-4-10-28)7-8-24(34)31-22-6-2-1-5-21(22)27(37)38/h1-2,5-6,15-17,23H,3-4,7-14H2,(H,31,34)(H,32,35)(H,37,38)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 443n/an/an/an/an/an/a



Rotta Research Laboratorium

Curated by ChEMBL


Assay Description
Inhibition of binding of [3H]N-Me-N-Leu-CCK-8 to cholecystokinin type B receptor in guinea pig brain cortex


J Med Chem 39: 135-42 (1996)


Article DOI: 10.1021/jm950372w
BindingDB Entry DOI: 10.7270/Q2BZ66P3
More data for this
Ligand-Target Pair