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BDBM50008291 2-{4-[(2-Amino-4-oxo-1,4-dihydro-pteridin-6-ylmethyl)-prop-2-ynyl-amino]-benzoylamino}-pentanedioic acid::2-{4-[(2-Amino-4-oxo-3,4-dihydro-pteridin-6-ylmethyl)-prop-2-ynyl-amino]-benzoylamino}-pentanedioic acid::CHEMBL280145
SMILES: Nc1nc2ncc(CN(CC#C)c3ccc(cc3)C(=O)NC(CCC(O)=O)C(O)=O)nc2c(=O)[nH]1
InChI Key: InChIKey=SQJGTVKPWANJGI-UHFFFAOYSA-N
Data: 5 IC50
| 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 |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Thymidylate synthase (Lactobacillus casei) | BDBM50008291![]() (CHEMBL280145 | 2-{4-[(2-Amino-4-oxo-1,4-dihydro-pt...) | GoogleScholar | UniChem | n/a | n/a | 3.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Thymidylate synthase (Lactobacillus casei) | BDBM50008291![]() (CHEMBL280145 | 2-{4-[(2-Amino-4-oxo-1,4-dihydro-pt...) | GoogleScholar | UniChem | n/a | n/a | 3.90E+5 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Thymidylate synthase (Mouse) | BDBM50008291![]() (CHEMBL280145 | 2-{4-[(2-Amino-4-oxo-1,4-dihydro-pt...) | GoogleScholar | UniChem | n/a | n/a | >3.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Thymidylate synthase (Mouse) | BDBM50008291![]() (CHEMBL280145 | 2-{4-[(2-Amino-4-oxo-1,4-dihydro-pt...) | GoogleScholar | UniChem | n/a | n/a | 7.50E+5 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Dihydrofolate reductase (Lactobacillus casei) | BDBM50008291![]() (CHEMBL280145 | 2-{4-[(2-Amino-4-oxo-1,4-dihydro-pt...) | GoogleScholar | UniChem | n/a | n/a | >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||