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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'General receptor of phosphoinositides 1 (GRP1)' AND taxid = 9606   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
General receptor of phosphoinositides 1 (GRP1)


(Homo sapiens (Human))
BDBM112785
PNG
(US8628961, DM-PIT-1)
Show SMILES Cc1cc(C)cc(c1)C(=O)NC(=S)Nc1cc(ccc1O)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O4S/c1-9-5-10(2)7-11(6-9)15(21)18-16(24)17-13-8-12(19(22)23)3-4-14(13)20/h3-8,20H,1-2H3,(H2,17,18,21,24)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

AffyNet 
US Patent
n/an/a 3.55E+4n/an/an/an/a7.525



Tufts University; Council of Scientific and Industrial Research

US Patent


Assay Description
In order to identify compounds that disrupt the interaction between PIP3 and PH domains, a high-throughput fluorescence polarization (FP)-binding ass...


US Patent US8628961 (2014)

More data for this
Ligand-Target Pair
General receptor of phosphoinositides 1 (GRP1)


(Homo sapiens (Human))
BDBM50013327
PNG
(CHEMBL3263343)
Show SMILES OC(=O)c1cc(n[nH]1)P(O)(O)=O
Show InChI InChI=1S/C4H5N2O5P/c7-4(8)2-1-3(6-5-2)12(9,10)11/h1H,(H,5,6)(H,7,8)(H2,9,10,11)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

AffyNet 
Article
PubMed
n/an/a 3.80E+4n/an/an/an/an/an/a



Sookmyung Women's University

Curated by ChEMBL


Assay Description
Inhibition of recombinant C-terminal 6xHis-tagged Grp1 PH domain (unknown origin) expressed in Escherichia coli BL21(DE3) RIL assessed as inhibition ...


Citation and Details
More data for this
Ligand-Target Pair
General receptor of phosphoinositides 1 (GRP1)


(Homo sapiens (Human))
BDBM112784
PNG
(US8628961, PIT-1)
Show SMILES Oc1c(Cl)cc(cc1NC(=S)NC(=O)c1ccccc1)[N+]([O-])=O
Show InChI InChI=1S/C14H10ClN3O4S/c15-10-6-9(18(21)22)7-11(12(10)19)16-14(23)17-13(20)8-4-2-1-3-5-8/h1-7,19H,(H2,16,17,20,23)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

AffyNet 
US Patent
n/an/a 4.03E+4n/an/an/an/a7.525



Tufts University; Council of Scientific and Industrial Research

US Patent


Assay Description
In order to identify compounds that disrupt the interaction between PIP3 and PH domains, a high-throughput fluorescence polarization (FP)-binding ass...


US Patent US8628961 (2014)

More data for this
Ligand-Target Pair