BDBM50125024 2-[(S)-3-(3-Guanidino-propyl)-2-oxo-3,4-dihydro-2H-pyrazin-1-yl]-N-[(S)-4-guanidino-1-(thiazole-2-carbonyl)-butyl]-acetamide::CHEMBL163527
SMILES: NC(=N)NCCC[C@H](NC(=O)CN1CC=N[C@@H](CCCNC(N)=N)C1=O)C(=O)c1nccs1
InChI Key: InChIKey=VVOSZONQEHUXTB-STQMWFEESA-N
Data: 2 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Coagulation factor X (Homo sapiens (Human)) | BDBM50125024 (2-[(S)-3-(3-Guanidino-propyl)-2-oxo-3,4-dihydro-2H...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 307 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Inc. Curated by ChEMBL | Assay Description In vitro inhibitory activity against factor Xa | Bioorg Med Chem Lett 13: 729-32 (2003) BindingDB Entry DOI: 10.7270/Q2T72GTS | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Prothrombin (Homo sapiens (Human)) | BDBM50125024 (2-[(S)-3-(3-Guanidino-propyl)-2-oxo-3,4-dihydro-2H...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 1.40E+5 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals Inc. Curated by ChEMBL | Assay Description In vitro inhibitory activity against serine protease thrombin | Bioorg Med Chem Lett 13: 729-32 (2003) BindingDB Entry DOI: 10.7270/Q2T72GTS | |||||||||||
More data for this Ligand-Target Pair |