BDBM50066773 (3R,6S,8aS)-6-Amino-5-oxo-hexahydro-thiazolo[3,2-a]pyridine-3-carboxylic acid (4-guanidino-butyl)-amide; TFA::CHEMBL120162
SMILES: N[C@H]1CC[C@@H]2SC[C@H](N2C1=O)C(=O)NCCCCNC(N)=N
InChI Key: InChIKey=BKWDBVATEVWOQC-GUBZILKMSA-N
Data: 2 KI
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Trypsin (Bos taurus (bovine)) | BDBM50066773 ((3R,6S,8aS)-6-Amino-5-oxo-hexahydro-thiazolo[3,2-a...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 3.58E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Pharma AG Curated by ChEMBL | Assay Description Invitro inhibition was measured against Human bovine pancreatic trypsin. | J Med Chem 41: 3664-74 (1998) Article DOI: 10.1021/jm981013e BindingDB Entry DOI: 10.7270/Q22R3QSZ | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Prothrombin (Homo sapiens (Human)) | BDBM50066773 ((3R,6S,8aS)-6-Amino-5-oxo-hexahydro-thiazolo[3,2-a...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 1.95E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Novartis Pharma AG Curated by ChEMBL | Assay Description Invitro inhibition was measured against Human Thrombin. | J Med Chem 41: 3664-74 (1998) Article DOI: 10.1021/jm981013e BindingDB Entry DOI: 10.7270/Q22R3QSZ | |||||||||||
More data for this Ligand-Target Pair |