BDBM50060418 5-Methylsulfanyl-6-trifluoromethyl-2,3-dihydro-indole-1-carboxylic acid pyridin-3-ylamide::CHEMBL276140::SB 221284

SMILES CSc1cc2CCN(C(=O)Nc3cccnc3)c2cc1C(F)(F)F

InChI Key InChIKey=OQZOXHCRSXYSPM-UHFFFAOYSA-N

Data  6 KI  10 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 16 hits for monomerid = 50060418   

TargetAromatase(Human)
Smithkline Beecham Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50060418(CHEMBL276140 | SB 221284 | 5-Methylsulfanyl-6-trif...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of heterologously expressed human Cytochrome P450 19A1 at 100 uMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Smithkline Beecham Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50060418(CHEMBL276140 | SB 221284 | 5-Methylsulfanyl-6-trif...)
Affinity DataIC50: 110nMAssay Description:Inhibition of heterologously expressed human Cytochrome P450 2D6 at 10 uMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Smithkline Beecham Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50060418(CHEMBL276140 | SB 221284 | 5-Methylsulfanyl-6-trif...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of heterologously expressed human Cytochrome P450 3A at 100 uMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
Smithkline Beecham Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50060418(CHEMBL276140 | SB 221284 | 5-Methylsulfanyl-6-trif...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of heterologously expressed human Cytochrome P450 2C9 at 100 uMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
Smithkline Beecham Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50060418(CHEMBL276140 | SB 221284 | 5-Methylsulfanyl-6-trif...)
Affinity DataIC50: 13nMAssay Description:Inhibition of heterologously expressed human Cytochrome P450 1A2 at 500 uMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCytochrome P450 2C19(Human)
Smithkline Beecham Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50060418(CHEMBL276140 | SB 221284 | 5-Methylsulfanyl-6-trif...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of heterologously expressed human cytochrome P450 2C19More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCytochrome P450 3A4(Human)
Smithkline Beecham Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50060418(CHEMBL276140 | SB 221284 | 5-Methylsulfanyl-6-trif...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of heterologously expressed human cytochrome P450 3A4More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCytochrome P450 2D6(Human)
Smithkline Beecham Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50060418(CHEMBL276140 | SB 221284 | 5-Methylsulfanyl-6-trif...)
Affinity DataIC50: 110nMAssay Description:Inhibition of heterologously expressed human cytochrome P450 2D6More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCytochrome P450 1A2(Human)
Smithkline Beecham Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50060418(CHEMBL276140 | SB 221284 | 5-Methylsulfanyl-6-trif...)
Affinity DataIC50: 13nMAssay Description:Inhibition of heterologously expressed human cytochrome P450 1A2More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
TargetCytochrome P450 2C9(Human)
Smithkline Beecham Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50060418(CHEMBL276140 | SB 221284 | 5-Methylsulfanyl-6-trif...)
Affinity DataIC50: 1.00E+5nMAssay Description:Inhibition of heterologously expressed human cytochrome P450 2C9More data for this Ligand-Target Pair
In Depth
Date in BDB:
11/10/2009
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2C(Human)
Vernalis Research

Curated by PDSP Ki Database
LigandPNGBDBM50060418(CHEMBL276140 | SB 221284 | 5-Methylsulfanyl-6-trif...)
Affinity DataKi:  2.19nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/31/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2B(Human)
Vernalis Research

Curated by PDSP Ki Database
LigandPNGBDBM50060418(CHEMBL276140 | SB 221284 | 5-Methylsulfanyl-6-trif...)
Affinity DataKi:  2.45nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/31/2012
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2C(Human)
Vernalis Research

Curated by PDSP Ki Database
LigandPNGBDBM50060418(CHEMBL276140 | SB 221284 | 5-Methylsulfanyl-6-trif...)
Affinity DataKi:  2.5nMAssay Description:Binding affinity towards cloned human 5-hydroxytryptamine 2C receptor expressed in HEK 293 cells using [3H]mesulergine as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2020
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2B(Human)
Vernalis Research

Curated by PDSP Ki Database
LigandPNGBDBM50060418(CHEMBL276140 | SB 221284 | 5-Methylsulfanyl-6-trif...)
Affinity DataKi:  13nMAssay Description:Binding affinity towards cloned human 5-hydroxytryptamine 2B receptor expressed in HEK 293 cells using [3H]5-HT as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2020
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2A(Human)
Smithkline Beecham Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50060418(CHEMBL276140 | SB 221284 | 5-Methylsulfanyl-6-trif...)
Affinity DataKi:  398nMAssay Description:Binding affinity towards human 5-hydroxytryptamine 2A receptor expressed in HEK 293 cells using [3H]ketanserin as radioligandMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2020
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 2A(Human)
Smithkline Beecham Pharmaceuticals

Curated by ChEMBL
LigandPNGBDBM50060418(CHEMBL276140 | SB 221284 | 5-Methylsulfanyl-6-trif...)
Affinity DataKi:  550nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
5/31/2012
Entry Details Article
PubMed