| Reaction Details |
|---|
 | Report a problem with these data |
| Target | Chitin synthase 1 |
|---|
| Ligand | BDBM50089553 |
|---|
| Substrate/Competitor | n/a |
|---|
| Meas. Tech. | ChEBML_49240 |
|---|
| IC50 | 391.0±n/a nM |
|---|
| Citation |  Masubuchi, K; Taniguchi, M; Umeda, I; Hattori, K; Suda, H; Kohchi, Y; Isshiki, Y; Sakai, T; Kohchi, M; Shirai, M; Okabe, H; Sudoh, M; Yamazaki, T; Shimma, N Synthesis and structure-activity relationships of novel fungal chitin synthase inhibitors. Bioorg Med Chem Lett10:1459-62 (2000) [PubMed] |
|---|
| More Info.: | Get all data from this article, Assay Method |
|---|
| |
| Chitin synthase 1 |
|---|
| Name: | Chitin synthase 1 |
|---|
| Synonyms: | CHS1 | CHS1_CANAX | Chitin synthase | Chitin synthase 1 |
|---|
| Type: | PROTEIN |
|---|
| Mol. Mass.: | 88249.31 |
|---|
| Organism: | Candida albicans |
|---|
| Description: | ChEMBL_49240 |
|---|
| Residue: | 776 |
|---|
| Sequence: | MHNINNGYVPNREKTITKRKVRLVGGKAGNLVLENPVPTELRKVLTRTESPFGEFTNMTY
TACTSQPDTFSAEGFTLRAAKYGRETEIVICITMYNEDEVAFARTMHGVMKNIAHLCSRH
KSKIWGKDSWKKVQVIIVADGRNKVQQSVLELLTATGCYQENLARPYVNNSKVNAHLFEY
TTQISIDENLKFKGDEKNLAPVQVLFCLKESNQKKINSHRWLFNAFCPVLDPNVIVLLDV
GTKPDNHAIYNLWKAFDRDSNVAGAAGEIKAMKGKGWINLTNPLVASQNFEYKLSNILDK
PLESLFGYISVLPGALSAYRYIALKNHDDGTGPLASYFKGEDLLCSHDKDKENTKANFFE
ANMYLAEDRILCWELVSKRNDNWVLKFVKSATGETDVPETIAEFLSQRRRWINGAFFAAL
YSLYHFRKIWTTDHSYARKFWLHVEEFIYQLVSLLFSFFSLSNFYLTFYFLTGSLVSYKS
LGKKGGFWIFTLFNYLCIGVLTSLFIVSIGNRPHASKNIFKTLIILLTICALYALVVGFV
FVINTIATFGTGGTSTYVLVSIVVSLLSTYGLYTLMSILYLDPWHMLTCSVQYFLMIPSY
TCTLQIFAFCNTHDVSWGTKGDNNPKEDLSNQYIIEKNASGEFEAVIVDTNIDEDYLETL
YNIRSKRSNKKVALGHSEKTPLDGDDYAKDVRTRVVLFWMIANLVFIMTMVQVYEPGDTG
RNIYLAFILWAVAVLALVRAIGSLGYLIQTYARFFVESKSKWMKRGYTAPSHNPLN
|
|
|
|---|
| BDBM50089553 |
|---|
| n/a |
|---|
| Name | BDBM50089553 |
|---|
| Synonyms: | CHEMBL32687 | N-((E)-6,6-Dimethyl-hept-2-en-4-ynyl)-N-(2-oxo-1,2,3,4-tetrahydro-quinolin-5-yl)-methanesulfonamide |
|---|
| Type | Small organic molecule |
|---|
| Emp. Form. | C19H24N2O3S |
|---|
| Mol. Mass. | 360.47 |
|---|
| SMILES | CC(C)(C)C#C\C=C\CN(c1cccc2NC(=O)CCc12)S(C)(=O)=O |
|---|
| Structure | 
|
|---|
Search and Browse
