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BDBM320434 2-[1-(4-fluorophenyl)-1- hydroxyethyl]-1H-pyrrolo[3,2-b]- pyridine-7-carboxylic acid::US10174026, Example 103::US9738637, Example 103

SMILES: CC(O)(c1cc2nccc(C(O)=O)c2[nH]1)c1ccc(F)cc1

InChI Key: InChIKey=WXTYMIIYUZEZMF-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 320434   
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))
BDBM320434
PNG
(2-[1-(4-fluorophenyl)-1- hydroxyethyl]-1H-pyrrolo[...)
Show SMILES CC(O)(c1cc2nccc(C(O)=O)c2[nH]1)c1ccc(F)cc1
Show InChI InChI=1S/C16H13FN2O3/c1-16(22,9-2-4-10(17)5-3-9)13-8-12-14(19-13)11(15(20)21)6-7-18-12/h2-8,19,22H,1H3,(H,20,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a<100n/an/an/an/an/an/a



CELGENE QUANTICEL 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 US10174026 (2019)


Article DOI: 10.1016/j.bmcl.2005.04.028
More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320434
PNG
(2-[1-(4-fluorophenyl)-1- hydroxyethyl]-1H-pyrrolo[...)
Show SMILES CC(O)(c1cc2nccc(C(O)=O)c2[nH]1)c1ccc(F)cc1
Show InChI InChI=1S/C16H13FN2O3/c1-16(22,9-2-4-10(17)5-3-9)13-8-12-14(19-13)11(15(20)21)6-7-18-12/h2-8,19,22H,1H3,(H,20,21)
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a<100n/an/an/an/an/an/a



CELGENE QUANTICEL 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 US10174026 (2019)


Article DOI: 10.1016/j.bmcl.2005.04.028
More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320434
PNG
(2-[1-(4-fluorophenyl)-1- hydroxyethyl]-1H-pyrrolo[...)
Show SMILES CC(O)(c1cc2nccc(C(O)=O)c2[nH]1)c1ccc(F)cc1
Show InChI InChI=1S/C16H13FN2O3/c1-16(22,9-2-4-10(17)5-3-9)13-8-12-14(19-13)11(15(20)21)6-7-18-12/h2-8,19,22H,1H3,(H,20,21)
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a<100n/an/an/an/an/an/a



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 US9738637 (2017)


Article DOI: 10.1021/jm030434f
More data for this
Ligand-Target Pair
Lysine-specific demethylase 5A


(Homo sapiens (Human))
BDBM320434
PNG
(2-[1-(4-fluorophenyl)-1- hydroxyethyl]-1H-pyrrolo[...)
Show SMILES CC(O)(c1cc2nccc(C(O)=O)c2[nH]1)c1ccc(F)cc1
Show InChI InChI=1S/C16H13FN2O3/c1-16(22,9-2-4-10(17)5-3-9)13-8-12-14(19-13)11(15(20)21)6-7-18-12/h2-8,19,22H,1H3,(H,20,21)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a<100n/an/an/an/an/an/a



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 US9738637 (2017)


Article DOI: 10.1021/jm030434f
More data for this
Ligand-Target Pair
Lysine-specific demethylase 5B


(Homo sapiens (Human))
BDBM320434
PNG
(2-[1-(4-fluorophenyl)-1- hydroxyethyl]-1H-pyrrolo[...)
Show SMILES CC(O)(c1cc2nccc(C(O)=O)c2[nH]1)c1ccc(F)cc1
Show InChI InChI=1S/C16H13FN2O3/c1-16(22,9-2-4-10(17)5-3-9)13-8-12-14(19-13)11(15(20)21)6-7-18-12/h2-8,19,22H,1H3,(H,20,21)
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a<100n/an/an/an/an/an/a



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 US9738637 (2017)


Article DOI: 10.1021/jm030434f
More data for this
Ligand-Target Pair
Lysine-specific demethylase 4C


(Homo sapiens (Human))
BDBM320434
PNG
(2-[1-(4-fluorophenyl)-1- hydroxyethyl]-1H-pyrrolo[...)
Show SMILES CC(O)(c1cc2nccc(C(O)=O)c2[nH]1)c1ccc(F)cc1
Show InChI InChI=1S/C16H13FN2O3/c1-16(22,9-2-4-10(17)5-3-9)13-8-12-14(19-13)11(15(20)21)6-7-18-12/h2-8,19,22H,1H3,(H,20,21)
PDB

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
Article
US Patent
n/an/a<100n/an/an/an/an/an/a



CELGENE QUANTICEL 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 US10174026 (2019)


Article DOI: 10.1016/j.bmcl.2005.04.028
More data for this
Ligand-Target Pair