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BDBM263970 2-(3-phenethyl-1H-pyrazol-1- yl)isonicotinic acid::US9714230, 35

SMILES: OC(=O)c1ccnc(c1)-n1ccc(CCc2ccccc2)n1

InChI Key: InChIKey=IKDUYJZLUXCOMP-UHFFFAOYSA-N

Data: 4 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 263970   
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
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM263970
PNG
(2-(3-phenethyl-1H-pyrazol-1- yl)isonicotinic acid ...)
Show SMILES OC(=O)c1ccnc(c1)-n1ccc(CCc2ccccc2)n1
Show InChI InChI=1S/C17H15N3O2/c21-17(22)14-8-10-18-16(12-14)20-11-9-15(19-20)7-6-13-4-2-1-3-5-13/h1-5,8-12H,6-7H2,(H,21,22)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 550n/an/an/an/an/a25



Celgene Quantical Research, Inc.

US Patent


Assay Description
The enzymatic assay of Jarid1A activity is based upon Time Resolved-Fluorescence Resonance Energy Transfer (TR-FRET) detection. The ability of test c...


US Patent US9714230 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4A


(Homo sapiens (Human))
BDBM263970
PNG
(2-(3-phenethyl-1H-pyrazol-1- yl)isonicotinic acid ...)
Show SMILES OC(=O)c1ccnc(c1)-n1ccc(CCc2ccccc2)n1
Show InChI InChI=1S/C17H15N3O2/c21-17(22)14-8-10-18-16(12-14)20-11-9-15(19-20)7-6-13-4-2-1-3-5-13/h1-5,8-12H,6-7H2,(H,21,22)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 550n/an/an/an/an/a25



Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2A was determined in 384-well plate format under the following reaction conditions: 2 nM...


US Patent US9714230 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM263970
PNG
(2-(3-phenethyl-1H-pyrazol-1- yl)isonicotinic acid ...)
Show SMILES OC(=O)c1ccnc(c1)-n1ccc(CCc2ccccc2)n1
Show InChI InChI=1S/C17H15N3O2/c21-17(22)14-8-10-18-16(12-14)20-11-9-15(19-20)7-6-13-4-2-1-3-5-13/h1-5,8-12H,6-7H2,(H,21,22)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 550n/an/an/an/an/a25



Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of JMJD2C was determined in 384-well plate format under the following reaction conditions: 0.3 ...


US Patent US9714230 (2017)

More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM263970
PNG
(2-(3-phenethyl-1H-pyrazol-1- yl)isonicotinic acid ...)
Show SMILES OC(=O)c1ccnc(c1)-n1ccc(CCc2ccccc2)n1
Show InChI InChI=1S/C17H15N3O2/c21-17(22)14-8-10-18-16(12-14)20-11-9-15(19-20)7-6-13-4-2-1-3-5-13/h1-5,8-12H,6-7H2,(H,21,22)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 550n/an/an/an/an/a25



Celgene Quantical Research, Inc.

US Patent


Assay Description
The ability of test compounds to inhibit the activity of Jarid1B was determined in 384-well plate format under the following reaction conditions: 0.8...


US Patent US9714230 (2017)

More data for this
Ligand-Target Pair