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BDBM50240584 CHEMBL4073517

SMILES: COc1cc(OC)c(F)c(COc2cnc(N[C@@H]3COCC[C@@H]3NC(=O)C=C)nc2)c1F

InChI Key: InChIKey=INDPOZGXJZSNRO-LSDHHAIUSA-N

Data: 2 IC50

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

Found 2 hits for monomerid = 50240584   
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
Fibroblast growth factor receptor 4


(Homo sapiens (Human))
BDBM50240584
PNG
(CHEMBL4073517)
Show SMILES COc1cc(OC)c(F)c(COc2cnc(N[C@@H]3COCC[C@@H]3NC(=O)C=C)nc2)c1F |r|
Show InChI InChI=1S/C21H24F2N4O5/c1-4-18(28)26-14-5-6-31-11-15(14)27-21-24-8-12(9-25-21)32-10-13-19(22)16(29-2)7-17(30-3)20(13)23/h4,7-9,14-15H,1,5-6,10-11H2,2-3H3,(H,26,28)(H,24,25,27)/t14-,15+/m0/s1
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 148n/an/an/an/an/an/a



WuXi AppTec (Shanghai) Co., Ltd.

Curated by ChEMBL


Assay Description
Concentration that inhibits the binding of radioligand, [3H]-ICS 205930, to 5-hydroxytryptamine 3 receptor from rat cortex


Bioorg Med Chem Lett 27: 2420-2423 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.014
BindingDB Entry DOI: 10.7270/Q2M90BT6
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM50240584
PNG
(CHEMBL4073517)
Show SMILES COc1cc(OC)c(F)c(COc2cnc(N[C@@H]3COCC[C@@H]3NC(=O)C=C)nc2)c1F |r|
Show InChI InChI=1S/C21H24F2N4O5/c1-4-18(28)26-14-5-6-31-11-15(14)27-21-24-8-12(9-25-21)32-10-13-19(22)16(29-2)7-17(30-3)20(13)23/h4,7-9,14-15H,1,5-6,10-11H2,2-3H3,(H,26,28)(H,24,25,27)/t14-,15+/m0/s1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



WuXi AppTec (Shanghai) Co., Ltd.

Curated by ChEMBL


Assay Description
Concentration that inhibits the binding of radioligand, [3H]-ICS 205930, to 5-hydroxytryptamine 3 receptor from rat cortex


Bioorg Med Chem Lett 27: 2420-2423 (2017)


Article DOI: 10.1016/j.bmcl.2017.04.014
BindingDB Entry DOI: 10.7270/Q2M90BT6
More data for this
Ligand-Target Pair