BDBM50247629 CHEMBL453384::N-(3-((tert-butylamino)methyl)-4-fluorophenyl)-7-chloroquinolin-4-amine::TCMDC-135909::[3-(tert-Butylaminomethyl)-4-fluorophenyl](7-chloro-quinolin-4-yl)amine

SMILES: CC(C)(C)NCc1cc(Nc2ccnc3cc(Cl)ccc23)ccc1F

InChI Key: InChIKey=OKGGBPZMSDNNFA-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 = 50247629   

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
Cytochrome P450 3A4 (Human)	BDBM50247629 (N-(3-((tert-butylamino)methyl)-4-fluorophenyl)-7-c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 1A2 (Human)	BDBM50247629 (N-(3-((tert-butylamino)methyl)-4-fluorophenyl)-7-c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 2D6 (Human)	BDBM50247629 (N-(3-((tert-butylamino)methyl)-4-fluorophenyl)-7-c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 2C8 (Human)	BDBM50247629 (N-(3-((tert-butylamino)methyl)-4-fluorophenyl)-7-c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	9.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 2C9 (Human)	BDBM50247629 (N-(3-((tert-butylamino)methyl)-4-fluorophenyl)-7-c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 2C19 (Human)	BDBM50247629 (N-(3-((tert-butylamino)methyl)-4-fluorophenyl)-7-c...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
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