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Target
V-type proton ATPase subunit S1
Ligand
BDBM50064441
Substrate
n/a
Meas. Tech.
ChEMBL_215469 (CHEMBL816939)
IC50
>10000±n/a nM
Citation
 Gagliardi, S; Gatti, PA; Belfiore, P; Zocchetti, A; Clarke, GD; Farina, C Synthesis and structure-activity relationships of bafilomycin A1 derivatives as inhibitors of vacuolar H+-ATPase. J Med Chem 41:1883-93 (1998) [PubMed]  Article 
Target
Name:
V-type proton ATPase subunit S1
Synonyms:
ATP6AP1 | ATP6IP1 | ATP6S1 | Protein XAP-3 | V-ATPase Ac45 subunit | V-ATPase S1 accessory protein | V-ATPase subunit S1 | V-type proton ATPase subunit S1 | VAS1_HUMAN | VATPS1 | Vacuolar ATP synthase subunit S1 | Vacuolar proton pump subunit S1 | XAP3
Type:
PROTEIN
Mol. Mass.:
52022.67
Organism:
Homo sapiens (Human)
Description:
ChEMBL_215469
Residue:
470
Sequence:
MMAAMATARVRMGPRCAQALWRMPWLPVFLSLAAAAAAAAAEQQVPLVLWSSDRDLWAPAADTHEGHITSDLQLSTYLDPALELGPRNVLLFLQDKLSIEDFTAYGGVFGNKQDSAFSNLENALDLAPSSLVLPAVDWYAVSTLTTYLQEKLGASPLHVDLATLRELKLNASLPALLLIRLPYTASSGLMAPREVLTGNDEVIGQVLSTLKSEDVPYTAALTAVRPSRVARDVAVVAGGLGRQLLQKQPVSPVIHPPVSYNDTAPRILFWAQNFSVAYKDQWEDLTPLTFGVQELNLTGSFWNDSFARLSLTYERLFGTTVTFKFILANRLYPVSARHWFTMERLEVHSNGSVAYFNASQVTGPSIYSFHCEYVSSLSKKGSLLVARTQPSPWQMMLQDFQIQAFNVMGEQFSYASDCASFFSPGIWMGLLTSLFMLFIFTYGLHMILSLKTMDRFDDHKGPTISLTQIV
  
Inhibitor
Name:
BDBM50064441
Synonyms:
(2S,3R,4S)-3-Hydroxy-4-((4E,6E,12E,14Z)-(2R,3S,9S,10S,11R)-10-hydroxy-3,15-dimethoxy-7,9,11,13-tetramethyl-16-oxo-oxacyclohexadeca-4,6,12,14-tetraen-2-yl)-2-methyl-pentanoic acid | CHEMBL293082
Type:
Small organic molecule
Emp. Form.:
C27H42O8
Mol. Mass.:
494.6176
SMILES:
CO[C@H]1\C=C\C=C(C)\C[C@H](C)[C@H](O)[C@H](C)\C=C(/C)\C=C(OC)\C(=O)O[C@@H]1[C@@H](C)[C@@H](O)[C@H](C)C(O)=O |c:5,15,18,t:3|
Structure:
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