BDBM50272272 CHEMBL502528::N-{4-[5-(2-Amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-6-yl)pentyl]benzoyl}-L-glutamic Acid

SMILES: Nc1nc2[nH]c(CCCCCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cc2c(=O)[nH]1

InChI Key: InChIKey=VGLCUJLZYVTUKW-KRWDZBQOSA-N

Data: 2 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 2 hits for monomerid = 50272272   

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
Glycinamide ribonucleotide formyltransferase (GARFTase) (Homo sapiens (Human))	BDBM50272272 (CHEMBL502528 | N-{4-[5-(2-Amino-4-oxo-4,7-dihydro-...) Show SMILES Nc1nc2[nH]c(CCCCCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cc2c(=O)[nH]1 |r| Show InChI InChI=1S/C23H27N5O6/c24-23-27-19-16(21(32)28-23)12-15(25-19)5-3-1-2-4-13-6-8-14(9-7-13)20(31)26-17(22(33)34)10-11-18(29)30/h6-9,12,17H,1-5,10-11H2,(H,26,31)(H,29,30)(H,33,34)(H4,24,25,27,28,32)/t17-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.20	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University School of Medicine Curated by ChEMBL					Assay Description Inhibition of GARFTase in human KB cells assessed as inhibition of [14C]glycine incorporation into [14C]formylGAR in presence of azaserine				J Med Chem 51: 5052-63 (2008) Article DOI: 10.1021/jm8003366 BindingDB Entry DOI: 10.7270/Q24F1RNB
					More data for this Ligand-Target Pair
GAR transformylase (Mus musculus)	BDBM50272272 (CHEMBL502528 | N-{4-[5-(2-Amino-4-oxo-4,7-dihydro-...) Show SMILES Nc1nc2[nH]c(CCCCCc3ccc(cc3)C(=O)N[C@@H](CCC(O)=O)C(O)=O)cc2c(=O)[nH]1 |r| Show InChI InChI=1S/C23H27N5O6/c24-23-27-19-16(21(32)28-23)12-15(25-19)5-3-1-2-4-13-6-8-14(9-7-13)20(31)26-17(22(33)34)10-11-18(29)30/h6-9,12,17H,1-5,10-11H2,(H,26,31)(H,29,30)(H,33,34)(H4,24,25,27,28,32)/t17-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.26E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wayne State University School of Medicine Curated by ChEMBL					Assay Description Inhibition of mouse recombinant GARFTase				J Med Chem 51: 5052-63 (2008) Article DOI: 10.1021/jm8003366 BindingDB Entry DOI: 10.7270/Q24F1RNB
					More data for this Ligand-Target Pair