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SMILES: CCn1c(CO)nn(-c2cc3c(cn(-c4c(F)ccc(OC)c4Cl)c(=O)c3cc2F)C(C)=C)c1=O

InChI Key:

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50549952   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM50549952 (CHEMBL4752247 | US11505536, Example 51) Show SMILES CCn1c(CO)nn(-c2cc3c(cn(-c4c(F)ccc(OC)c4Cl)c(=O)c3cc2F)C(C)=C)c1=O |(18.24,-18.73,;17.61,-17.33,;16.08,-17.17,;15.31,-15.83,;15.94,-14.43,;17.47,-14.26,;13.81,-16.15,;13.65,-17.69,;12.32,-18.45,;10.99,-17.68,;9.65,-18.45,;8.32,-17.68,;6.98,-18.45,;6.99,-19.99,;5.66,-20.76,;4.32,-20,;4.32,-18.46,;2.99,-20.77,;2.99,-22.31,;4.32,-23.08,;4.33,-24.62,;5.66,-25.39,;5.66,-22.31,;7,-23.08,;8.33,-20.76,;8.33,-22.3,;9.65,-19.99,;10.98,-20.77,;12.32,-20,;13.65,-20.77,;8.32,-16.14,;9.65,-15.37,;6.98,-15.37,;15.05,-18.31,;15.37,-19.82,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	0.267	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2WS8Z24
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Homo sapiens (Human))	BDBM50549952 (CHEMBL4752247 | US11505536, Example 51) Show SMILES CCn1c(CO)nn(-c2cc3c(cn(-c4c(F)ccc(OC)c4Cl)c(=O)c3cc2F)C(C)=C)c1=O |(18.24,-18.73,;17.61,-17.33,;16.08,-17.17,;15.31,-15.83,;15.94,-14.43,;17.47,-14.26,;13.81,-16.15,;13.65,-17.69,;12.32,-18.45,;10.99,-17.68,;9.65,-18.45,;8.32,-17.68,;6.98,-18.45,;6.99,-19.99,;5.66,-20.76,;4.32,-20,;4.32,-18.46,;2.99,-20.77,;2.99,-22.31,;4.32,-23.08,;4.33,-24.62,;5.66,-25.39,;5.66,-22.31,;7,-23.08,;8.33,-20.76,;8.33,-22.3,;9.65,-19.99,;10.98,-20.77,;12.32,-20,;13.65,-20.77,;8.32,-16.14,;9.65,-15.37,;6.98,-15.37,;15.05,-18.31,;15.37,-19.82,)| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	0.267	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details Article DOI: 10.1021/acsmedchemlett.0c00669 BindingDB Entry DOI: 10.7270/Q2VM4GWJ
					More data for this Ligand-Target Pair