null
SMILES: Cn1c(CNC(=O)[C@@H]2C=CCN2C(=O)[C@@H](CC2CCCCC2)NCC(O)=O)ccc1C(N)=N
InChI Key: InChIKey=FJEFRQXMVIMNDT-MJGOQNOKSA-N
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Serine protease 1 (Bos taurus (bovine)) | BDBM50129034 (((R)-2-{(S)-2-[(5-Carbamimidoyl-1H-pyrrol-2-ylmeth...) | PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
BASF AG Curated by ChEMBL | Assay Description In vitro inhibitory activity against trypsin | Bioorg Med Chem Lett 13: 2029-33 (2003) BindingDB Entry DOI: 10.7270/Q22F7P0N | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Prothrombin (Homo sapiens (Human)) | BDBM50129034 (((R)-2-{(S)-2-[(5-Carbamimidoyl-1H-pyrrol-2-ylmeth...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 6.20 | n/a | n/a | n/a | n/a | n/a | n/a |
Abbott GmbH& Co. KG Curated by ChEMBL | Assay Description Inhibition of thrombin | Bioorg Med Chem Lett 16: 2641-7 (2006) Article DOI: 10.1016/j.bmcl.2006.02.040 BindingDB Entry DOI: 10.7270/Q2MC90T5 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Prothrombin (Homo sapiens (Human)) | BDBM50129034 (((R)-2-{(S)-2-[(5-Carbamimidoyl-1H-pyrrol-2-ylmeth...) | PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 6.20 | n/a | n/a | n/a | n/a | n/a | n/a |
BASF AG Curated by ChEMBL | Assay Description In vitro inhibitory activity against thrombin | Bioorg Med Chem Lett 13: 2029-33 (2003) BindingDB Entry DOI: 10.7270/Q22F7P0N | |||||||||||
More data for this Ligand-Target Pair |