BDBM593016 US11576897, Example 301

SMILES CNCc1cc(OCc2ccc(F)cc2Cl)n(n1)C(C)C1CCCCC1

InChI Key InChIKey=RUSAHTDLQCANTM-UHFFFAOYSA-N

Data  3 KI

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 593016   

Target5-hydroxytryptamine receptor 2A(Human)
Sumitomo Pharma

US Patent
LigandPNGBDBM593016(US11576897, Example 301)
Affinity DataKi:  0.880nMAssay Description:5-HT2A: A solution containing 50 μL of [H]-ketanserin (the final concentration: 1 nM), 2 μL of a solution of a test compound in DMSO or a s...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/31/2023
Entry Details
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TargetSodium-dependent serotonin transporter(Human)
Sumitomo Pharma

US Patent
LigandPNGBDBM593016(US11576897, Example 301)
Affinity DataKi:  1.30nMAssay Description:Specifically, a solution containing 50 μL of [3H]-citalopram (GE Healthcare) diluted with SERT buffer (50 mmol/L Tris-HCl (pH=7.4) containing 12...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/31/2023
Entry Details
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Target5-hydroxytryptamine receptor 2C(Human)
Sumitomo Pharma

US Patent
LigandPNGBDBM593016(US11576897, Example 301)
Affinity DataKi:  4.60nMAssay Description:5-HT2C: A solution containing 50 μL of [H]-mesulergine (GE Healthcare) diluted with 50 mmol/L Tris-HCl (pH=7.4) (the final concentration: about ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
3/31/2023
Entry Details
Go to US Patent