Reaction Details |
| Report a problem with these data |
Target | Cysteine proteinase falcipain 3 |
---|
Ligand | BDBM50513167 |
---|
Substrate/Competitor | n/a |
---|
Meas. Tech. | ChEMBL_1852105 (CHEMBL4352729) |
---|
IC50 | 851±n/a nM |
---|
Citation | Stoye, A; Juillard, A; Tang, AH; Legac, J; Gut, J; White, KL; Charman, SA; Rosenthal, PJ; Grau, GER; Hunt, NH; Payne, RJ Falcipain Inhibitors Based on the Natural Product Gallinamide A Are Potent in Vitro and in Vivo Antimalarials. J Med Chem62:5562-5578 (2019) [PubMed] Article |
---|
More Info.: | Get all data from this article, Assay Method |
---|
|
Cysteine proteinase falcipain 3 |
---|
Name: | Cysteine proteinase falcipain 3 |
Synonyms: | Cysteine protease falcipain-3 |
Type: | Protein |
Mol. Mass.: | 56666.98 |
Organism: | Plasmodium falciparum |
Description: | Q9NAW4 |
Residue: | 492 |
Sequence: | MEYHMEYSPNEVIKQEREVFVGKEKSGSKFKRKRSIFIVLTVSICFMFALMLFYFTRNEN
NKTLFTNSLSNNINDDYIINSLLKSESGKKFIVSKLEELISSYDKEKKMRTTGAEENNMN
MNGIDDKDNKSVSFVNKKNGNLKVNNNNQVSYSNLFDTKFLMDNLETVNLFYIFLKENNK
KYETSEEMQKRFIIFSENYRKIELHNKKTNSLYKRGMNKFGDLSPEEFRSKYLNLKTHGP
FKTLSPPVSYEANYEDVIKKYKPADAKLDRIAYDWRLHGGVTPVKDQALCGSCWAFSSVG
SVESQYAIRKKALFLFSEQELVDCSVKNNGCYGGYITNAFDDMIDLGGLCSQDDYPYVSN
LPETCNLKRCNERYTIKSYVSIPDDKFKEALRYLGPISISIAASDDFAFYRGGFYDGECG
AAPNHAVILVGYGMKDIYNEDTGRMEKFYYYIIKNSWGSDWGEGGYINLETDENGYKKTC
SIGTEAYVPLLE
|
|
|
BDBM50513167 |
---|
n/a |
---|
Name | BDBM50513167 |
Synonyms: | CHEMBL4564002 |
Type | Small organic molecule |
Emp. Form. | C43H55F3N6O8 |
Mol. Mass. | 840.9274 |
SMILES | OC(=O)C(F)(F)F.COC1=CC(=O)N([C@H]1Cc1c[nH]c2ccccc12)C(=O)\C=C\[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C(C)C)N(C)C |r,t:8| |
Structure |
|