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3 similar compounds to monomer 50227641

Compile data set for download or QSAR
Wt: 442.5
BDBM50227646
Wt: 330.7
BDBM50165205
Wt: 176.2
BDBM50230279

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50227646,50165205,50230279   
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
Serotonin (5-HT) receptor


(Rattus norvegicus (rat))
BDBM50165205
PNG
(CHEMBL3798961)
Show SMILES FC(F)(F)c1cccc(NC(=S)Nc2ccccc2Cl)c1
Show InChI InChI=1S/C14H10ClF3N2S/c15-11-6-1-2-7-12(11)20-13(21)19-10-5-3-4-9(8-10)14(16,17)18/h1-8H,(H2,19,20,21)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Medical University of Warsaw

Curated by ChEMBL


Assay Description
Displacement of [3H]ketanserin from 5HT2A receptor in Sprague-Dawley rat brain cortex incubated for 15 mins


Eur J Med Chem 116: 173-186 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.073
BindingDB Entry DOI: 10.7270/Q22B90X6
More data for this
Ligand-Target Pair
Serotonin (5-HT) receptor


(Rattus norvegicus (Rat))
BDBM50165205
PNG
(CHEMBL3798961)
Show SMILES FC(F)(F)c1cccc(NC(=S)Nc2ccccc2Cl)c1
Show InChI InChI=1S/C14H10ClF3N2S/c15-11-6-1-2-7-12(11)20-13(21)19-10-5-3-4-9(8-10)14(16,17)18/h1-8H,(H2,19,20,21)
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
>1.00E+4n/an/an/an/an/an/an/an/a



Medical University of Warsaw

Curated by ChEMBL


Assay Description
Displacement of [3H]mesulergine from 5HT2C receptor in Sprague-Dawley rat brain cortex incubated for 15 mins


Eur J Med Chem 116: 173-186 (2016)


Article DOI: 10.1016/j.ejmech.2016.03.073
BindingDB Entry DOI: 10.7270/Q22B90X6
More data for this
Ligand-Target Pair
Protein kinase C (PKC)


(Homo sapiens (Human))
BDBM50227646
PNG
(CHEMBL51563)
Show SMILES [Br-].CCCCCCCCCCCCCCCCOCCC[n+]1ccccc1
Show InChI InChI=1S/C24H44NO.BrH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-18-23-26-24-19-22-25-20-16-15-17-21-25;/h15-17,20-21H,2-14,18-19,22-24H2,1H3;1H/q+1;/p-1
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>4.00E+4n/an/an/an/an/an/a



University of North Carolina

Curated by ChEMBL


Assay Description
Inhibition of Protein Kinase C (PKC) isolated from HL-60 human promyelocytic leukemia cells


J Med Chem 33: 1812-8 (1990)


Article DOI: 10.1021/jm00168a042
BindingDB Entry DOI: 10.7270/Q2K35WW7
More data for this
Ligand-Target Pair
Phosphodiesterase 3


(Homo sapiens (Human))
BDBM50230279
PNG
(CHEMBL144706)
Show SMILES Cc1nccc2nc(S)ccc12
Show InChI InChI=1S/C9H8N2S/c1-6-7-2-3-9(12)11-8(7)4-5-10-6/h2-5H,1H3,(H,11,12)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 960n/an/an/an/an/an/a



Sterling Winthrop Pharmaceuticals Research Division

Curated by ChEMBL


Assay Description
Inhibition of cAMP Phosphodiesterase 3


J Med Chem 35: 4858-65 (1992)


Article DOI: 10.1021/jm00104a012
BindingDB Entry DOI: 10.7270/Q2H13480
More data for this
Ligand-Target Pair