BDBM16111 2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}cyclopent-1-ene-1-carboxylic acid::Biphenyl-4-ylcarbamoyl Cyclopentene Analog 2::CHEMBL197194::US20240199535, Example 6

SMILES: COc1cccc(c1)-c1ccc(NC(=O)C2=C(CCC2)C(O)=O)c(F)c1

InChI Key: InChIKey=XPRDUGXOWVXZLL-UHFFFAOYSA-N

Data: 4 KI  8 IC50  3 Kd  16 EC50

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 34 hits for monomerid = 16111   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Peroxisome proliferator-activated receptor gamma (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
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Nuclear receptor subfamily 4 group A member 2 (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	79	n/a	n/a	n/a	n/a
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Dihydroorotate dehydrogenase (quinone), mitochondrial (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	610	n/a	n/a	n/a	n/a	n/a	n/a
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Dihydroorotate dehydrogenase (quinone), mitochondrial (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
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Nuclear receptor subfamily 4 group A member 1 (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	3.10E+3	n/a	n/a	n/a	n/a
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Nuclear receptor subfamily 4 group A member 3 (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	2.90E+3	n/a	n/a	n/a	n/a
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Thyroid hormone receptor alpha (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
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Retinoic acid receptor alpha (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
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Peroxisome proliferator-activated receptor alpha (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
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Nuclear receptor subfamily 4 group A member 2 (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	400	n/a	n/a	n/a	n/a
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Vitamin D3 receptor (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
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Bile acid receptor (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
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Retinoic acid receptor RXR-alpha (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a
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Nuclear receptor subfamily 4 group A member 2 (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a
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Metallo-beta-lactamase type 2 (Pseudomonas aeruginosa (g-Proteobacteria))	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.38E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Metallo-beta-lactamase type 2 (Pseudomonas aeruginosa (g-Proteobacteria))	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	3.40	n/a	n/a	n/a	n/a	n/a
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Dihydroorotate dehydrogenase (quinone), mitochondrial (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.32E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Nuclear receptor subfamily 4 group A member 2 (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	700	n/a	n/a	n/a	n/a	n/a
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Dihydroorotate dehydrogenase (quinone), mitochondrial (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	554	n/a	n/a	n/a	n/a	n/a	n/a
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Dihydroorotate dehydrogenase (quinone), mitochondrial (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	2.80E+3	n/a	n/a	n/a	n/a
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Dihydroorotate dehydrogenase (quinone), mitochondrial (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	2.75E+3	n/a	n/a	n/a	n/a
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Bifunctional peptidase and (3S)-lysyl hydroxylase JMJD7 (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.16E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Dihydroorotate dehydrogenase (quinone), mitochondrial (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	134	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	134	n/a	n/a	n/a	n/a	n/a	n/a
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Bile acid receptor (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	450	n/a	n/a	n/a	n/a
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Nuclear receptor subfamily 4 group A member 2 (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	400	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Nuclear receptor subfamily 4 group A member 2 (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	300	n/a	n/a	n/a	n/a
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Dihydroorotate dehydrogenase (quinone), mitochondrial [30-395] (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	134	n/a	n/a	n/a	n/a	8.0	25
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Dihydroorotate dehydrogenase (quinone), mitochondrial (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		245	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Dihydroorotate dehydrogenase (quinone), mitochondrial (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		521	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		524	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		570	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		592	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Human)	BDBM16111 (2-{[2-fluoro-4-(3-methoxyphenyl)phenyl]carbamoyl}c...) Show SMILES Show InChI	GoogleScholar	UniChem		592	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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