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SMILES: Nc1nc-2c(CCc3ccc(OP(O)(O)=O)cc-23)s1

InChI Key: InChIKey=SJPRRARYUZBNAD-UHFFFAOYSA-N

PDB links: 1 PDB ID matches this monomer.

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50302495   
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
Fructose-1,6-bisphosphatase 1


(Homo sapiens (Human))
BDBM50302495
PNG
(2-amino-4,5-dihydronaphtho[1,2-d][1,3]thiazol-8-yl...)
Show SMILES Nc1nc-2c(CCc3ccc(OP(O)(O)=O)cc-23)s1
Show InChI InChI=1S/C11H11N2O4PS/c12-11-13-10-8-5-7(17-18(14,15)16)3-1-6(8)2-4-9(10)19-11/h1,3,5H,2,4H2,(H2,12,13)(H2,14,15,16)
PDB

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PC cid
PC sid
PDB
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Similars

PDB
Article
PubMed
n/an/a 13n/an/an/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human liver FBPase


Bioorg Med Chem Lett 19: 5909-12 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.081
BindingDB Entry DOI: 10.7270/Q23J3D22
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)