BDBM50519107 CHEMBL4460438
SMILES: C[C@@H](NC(=O)c1cc(nn1C)-c1ccccc1)c1ccc(cc1)N1C(=O)CNC1=O
InChI Key: InChIKey=XDKLWSNAVQWLIC-CQSZACIVSA-N
Data: 1 IC50
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 |
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D-3-phosphoglycerate dehydrogenase (Homo sapiens (Human)) | BDBM50519107 (CHEMBL4460438) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | PC cid PC sid UniChem | Article PubMed | n/a | n/a | 2.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Boehringer Ingelheim RCV GmbH & Co. KG Curated by ChEMBL | Assay Description Inhibition of N-terminal His6-tagged human PHGDH (4 to 315 residues) assessed as effect on NADH fluorescence incubated for 2 hrs using 3-PG substrate... | J Med Chem 62: 7976-7997 (2019) Article DOI: 10.1021/acs.jmedchem.9b00718 | |||||||||||
More data for this Ligand-Target Pair |