BDBM50393640 CHEMBL2158681

SMILES: c1c(csc1C(=O)N[C@@H](CCC(=O)O)C(=O)O)CCCCc2cc3c([nH]2)N=C(NC3=O)N

InChI Key: InChIKey=VMGGIKVXYOZFJO-UHFFFAOYSA-N

Data: 3 KI  9 IC50

PDB links: 1 PDB ID matches this monomer.

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 12 hits for monomerid = 50393640   

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
Folate receptor beta (Human)	BDBM50393640 (CHEMBL2158681) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.430	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Trifunctional purine biosynthetic protein adenosine-3 (Human)	BDBM50393640 (CHEMBL2158681) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	0.600	n/a	n/a	n/a	n/a	n/a	n/a
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Folate receptor alpha (Human)	BDBM50393640 (CHEMBL2158681) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.5	n/a	n/a	n/a	n/a	n/a	n/a
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Proton-coupled folate transporter (Human)	BDBM50393640 (CHEMBL2158681) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	73	n/a	n/a	n/a	n/a	n/a	n/a
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Reduced folate transporter (Human)	BDBM50393640 (CHEMBL2158681) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Proton-coupled folate transporter (Human)	BDBM50393640 (CHEMBL2158681) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	42	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Folate receptor beta (Human)	BDBM50393640 (CHEMBL2158681) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Reduced folate transporter (Human)	BDBM50393640 (CHEMBL2158681) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Trifunctional purine biosynthetic protein adenosine-3 (Human)	BDBM50393640 (CHEMBL2158681) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.79	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Proton-coupled folate transporter (Human)	BDBM50393640 (CHEMBL2158681) Show SMILES Show InChI	GoogleScholar	UniChem		360	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
Proton-coupled folate transporter (Human)	BDBM50393640 (CHEMBL2158681) Show SMILES Show InChI	GoogleScholar	UniChem		390	n/a	n/a	n/a	n/a	n/a	n/a	5.5	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Proton-coupled folate transporter (Human)	BDBM50393640 (CHEMBL2158681) Show SMILES Show InChI	GoogleScholar	UniChem		2.81E+4	n/a	n/a	n/a	n/a	n/a	n/a	6.8	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair