Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL27903985 | 0.68 | CYP2A6 (0.44) | CYP2A6KDM4EALDH1A1SMN1; SMN2 | |
| Bromide SCHEMBL28124645 | 0.67 | CYP2A6 (0.43) | CYP2A6KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL970243 | 0.65 | CYP3A4 (0.39) | CYP2A6ALDH1A1 | |
| SCHEMBL27954289 | 0.64 | LMNA (0.38) | CYP2A6KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL18049511 | 0.61 | KDM4E (0.34) | CYP2A6KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL27859244 | 0.61 | CYP2A6 (0.61) | CYP2A6KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL14860938 | 0.60 | CYP2A6 (0.37) | CYP2A6KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL27905069 | 0.60 | SMN1; SMN2 (0.72) | CYP2A6KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL18327504 | 0.58 | KDM4E (0.35) | CYP2A6KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL9078549 | 0.58 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105503850-B | N [base of 4 tert-butyl group 5 (base of 1,2,4 triazole 1) thiazole 2] lauramides and its application | 湖南大学 | 2018-01-09 | — | — | CN | disclosed |
| CN-104876924-B | 3 [base] benzoxazinones of 5 (base of 1,2,4 triazole 1) thiazole 2 and preparation method and application | 湖南大学 | 2017-06-23 | — | — | CN | disclosed |
| CN-105503850-A | N-[5-(1,2,4-triazol-1-yl)thiazol-2-yl]lauramide and application thereof | UNIV HUNAN | 2016-04-20 | — | — | CN | disclosed |
| CN-103664928-B | N- [5- (1,2, 4-triazol-1-yl) thiazol-2-yl ] fatty amide and application thereof | HUNAN UNIVERSITY (CN) | 2015-10-07 | — | — | CN | disclosed |
| CN-103664927-B | N-[5-(1,2,4-triazole-1-yl)thiazole-2-yl]aryl amide, preparation method, and applications thereof | UNIV HUNAN | 2015-06-24 | — | — | CN | disclosed |
| CN-104628716-A | N-[5-(1,2,4-triazolyl-1-yl)thiazolyl-2-yl]lauramide and application thereof | UNIV HUNAN | 2015-05-20 | — | — | CN | disclosed |