Reaction Details | |||
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Target | Suppressor of tumorigenicity 14 protein | ||
Ligand | BDBM50017925 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_1364433 (CHEMBL3294545) | ||
Ki | 824±n/a nM | ||
Citation | Goswami, R; Mukherjee, S; Ghadiyaram, C; Wohlfahrt, G; Sistla, RK; Nagaraj, J; Satyam, LK; Subbarao, K; Palakurthy, RK; Gopinath, S; Krishnamurthy, NR; Ikonen, T; Moilanen, A; Subramanya, HS; Kallio, P; Ramachandra, M Structure-guided discovery of 1,3,5 tri-substituted benzenes as potent and selective matriptase inhibitors exhibiting in vivo antitumor efficacy. Bioorg Med Chem22:3187-203 (2014) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Suppressor of tumorigenicity 14 protein | |||
Name: | Suppressor of tumorigenicity 14 protein | ||
Synonyms: | Epithin | Hepatocyte growth factor activator/Serine protease hepsin/Suppressor of tumorigenicity 14 protein | MT-SP1 | Membrane-type serine protease 1 | PRSS14 | Prostamin | SNC19 | ST14 | ST14_HUMAN | Serine protease TADG-15 | Suppressor of tumorigenicity 14 protein | Suppressor of tumorigenicity protein 14 | TADG15 | ||
Type: | Single-pass type II membrane protein | ||
Mol. Mass.: | 94769.23 | ||
Organism: | Homo sapiens (Human) | ||
Description: | Q9Y5Y6 | ||
Residue: | 855 | ||
Sequence: |
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BDBM50017925 | |||
n/a | |||
Name | BDBM50017925 | ||
Synonyms: | CHEMBL3289041 | ||
Type | Small organic molecule | ||
Emp. Form. | C27H29N5O4 | ||
Mol. Mass. | 487.5503 | ||
SMILES | N[C@H]1CC[C@@H](CC1)NC(=O)c1cc(Oc2ccc(cc2)C(N)=N)cc(Oc2ccc(cc2)C(N)=O)c1 |r,wU:4.7,wD:1.0,(15.46,-14.03,;14.12,-13.26,;14.12,-11.72,;12.79,-10.95,;11.46,-11.72,;11.46,-13.26,;12.79,-14.03,;10.12,-10.95,;8.79,-11.72,;8.79,-13.26,;7.46,-10.95,;6.12,-11.72,;4.79,-10.95,;3.45,-11.72,;2.12,-10.95,;.79,-11.72,;-.55,-10.95,;-.55,-9.41,;.79,-8.64,;2.12,-9.41,;-1.88,-8.64,;-3.21,-9.41,;-1.88,-7.1,;4.79,-9.41,;6.12,-8.64,;6.12,-7.1,;7.46,-6.33,;7.46,-4.79,;8.79,-4.02,;10.12,-4.79,;10.12,-6.33,;8.79,-7.1,;11.46,-4.02,;12.79,-4.79,;11.46,-2.48,;7.46,-9.41,)| | ||
Structure |