BDBM50298803 (+/-)-6-methyl-5-(3-(3,4,5-trimethoxyphenyl)pent-1-ynyl)pyrimidine-2,4-diamine::CHEMBL574335::Propargyl-substituted antifolate, 18

SMILES: CC[C@@H](C#Cc1c(nc(nc1N)N)C)c2cc(c(c(c2)OC)OC)OC

InChI Key: InChIKey=LMNOGGWYIMBHHK-UHFFFAOYSA-N

Data: 1 KI  5 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 = 50298803   

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
Dihydrofolate reductase (Yeast)	BDBM50298803 (CHEMBL574335 | Propargyl-substituted antifolate, 1...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
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Dihydrofolate reductase (Human)	BDBM50298803 (CHEMBL574335 | Propargyl-substituted antifolate, 1...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
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Dihydrofolate reductase (Human)	BDBM50298803 (CHEMBL574335 | Propargyl-substituted antifolate, 1...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
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Dihydrofolate reductase (Yeast)	BDBM50298803 (CHEMBL574335 | Propargyl-substituted antifolate, 1...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
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Dihydrofolate reductase (Bacillus anthracis)	BDBM50298803 (CHEMBL574335 | Propargyl-substituted antifolate, 1...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Dihydrofolate reductase (Bacillus anthracis)	BDBM50298803 (CHEMBL574335 | Propargyl-substituted antifolate, 1...) Show SMILES Show InChI	GoogleScholar	UniChem		3.37E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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