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2 similar compounds to monomer 50061218

Compile data set for download or QSAR
Wt: 473.5
BDBM50355873
Wt: 395.4
BDBM50367648

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50355873,50367648   
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
Sentrin-specific protease 1 (SENP1)


(Homo sapiens (Human))
BDBM50355873
PNG
(CHEMBL1910016)
Show SMILES O=CCN1c2ccccc2C(=NC(NC(=O)\C=C\c2ccc3ccccc3c2)C1=O)c1ccccc1
Show InChI InChI=1S/C30H23N3O3/c34-19-18-33-26-13-7-6-12-25(26)28(23-9-2-1-3-10-23)32-29(30(33)36)31-27(35)17-15-21-14-16-22-8-4-5-11-24(22)20-21/h1-17,19-20,29H,18H2,(H,31,35)/b17-15+
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PubMed
n/an/a 2.18E+4n/an/an/an/an/an/a



Shanghai Jiao Tong University

Curated by ChEMBL


Assay Description
Inhibition of histidine-tagged human SENP1 catalytic domain preincubated for 10 mins by SUMO-CHOP-PLA2 reporter fluorescence assay


Bioorg Med Chem Lett 21: 6389-92 (2011)


Article DOI: 10.1016/j.bmcl.2011.08.101
BindingDB Entry DOI: 10.7270/Q2FQ9X1X
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50367648
PNG
(CHEMBL1907661)
Show SMILES CN1c2ccccc2C(=N[C@H](NC(=O)\C=C\c2ccccc2)C1=O)c1ccccc1
Show InChI InChI=1S/C25H21N3O2/c1-28-21-15-9-8-14-20(21)23(19-12-6-3-7-13-19)27-24(25(28)30)26-22(29)17-16-18-10-4-2-5-11-18/h2-17,24H,1H3,(H,26,29)/b17-16+/t24-/m0/s1
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n/an/a 640n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Half-maximal inhibition of [125I]-CCK-8(+) binding to cholecystokinin receptor from guinea pig brain tissue


J Med Chem 31: 2235-46 (1989)


Article DOI: 10.1021/jm00120a002
BindingDB Entry DOI: 10.7270/Q2PG1S9K
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50367648
PNG
(CHEMBL1907661)
Show SMILES CN1c2ccccc2C(=N[C@H](NC(=O)\C=C\c2ccccc2)C1=O)c1ccccc1
Show InChI InChI=1S/C25H21N3O2/c1-28-21-15-9-8-14-20(21)23(19-12-6-3-7-13-19)27-24(25(28)30)26-22(29)17-16-18-10-4-2-5-11-18/h2-17,24H,1H3,(H,26,29)/b17-16+/t24-/m0/s1
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n/an/a 180n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Half-maximal inhibition of [125I]gastrin binding to guinea pig gastric glands


J Med Chem 31: 2235-46 (1989)


Article DOI: 10.1021/jm00120a002
BindingDB Entry DOI: 10.7270/Q2PG1S9K
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(RAT)
BDBM50367648
PNG
(CHEMBL1907661)
Show SMILES CN1c2ccccc2C(=N[C@H](NC(=O)\C=C\c2ccccc2)C1=O)c1ccccc1
Show InChI InChI=1S/C25H21N3O2/c1-28-21-15-9-8-14-20(21)23(19-12-6-3-7-13-19)27-24(25(28)30)26-22(29)17-16-18-10-4-2-5-11-18/h2-17,24H,1H3,(H,26,29)/b17-16+/t24-/m0/s1
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n/an/a 0.300n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Half-maximal inhibition of [125I]CCK-8 binding to cholecystokinin receptor from rat pancreatic tissue


J Med Chem 31: 2235-46 (1989)


Article DOI: 10.1021/jm00120a002
BindingDB Entry DOI: 10.7270/Q2PG1S9K
More data for this
Ligand-Target Pair