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SMILES: Clc1ccc(cc1)[C@H]1C[C@@H](CO1)c1noc(Cn2ncn3c(cccc3=O)c2=O)n1

InChI Key: InChIKey=ADSGDRJGOSICMK-XJKSGUPXSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 452604   
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
Transient receptor potential cation channel subfamily A member 1


(Homo sapiens (Human))		BDBM452604
PNG
(2-((3-((3R,5R)-5-(4- chlorophenyl)tetrahydro- fura...)
Show SMILES Clc1ccc(cc1)[C@H]1C[C@@H](CO1)c1noc(Cn2ncn3c(cccc3=O)c2=O)n1 |r|
Show InChI InChI=1S/C20H16ClN5O4/c21-14-6-4-12(5-7-14)16-8-13(10-29-16)19-23-17(30-24-19)9-26-20(28)15-2-1-3-18(27)25(15)11-22-26/h1-7,11,13,16H,8-10H2/t13-,16+/m0/s1
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
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PC cid
PC sid
UniChem
US Patent
n/an/a 2.40n/an/an/an/an/an/a



Genentech, Inc.

US Patent


Assay Description
The IC50 (effective concentration) of compounds on the human TRPA1 channel was determined using a FLIPR Tetra instrument. CHO cells expressing TRPA1 ...

US Patent US10710994 (2020)

More data for this
Ligand-Target Pair