Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN11 | Q06124 | 1/20 | 0.53 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.51 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.51 |
| ▸ | ITGAL | P20701 | 1/20 | 0.51 |
| ▸ | GAA | P10253 | 3/20 | 0.51 |
| ▸ | FBP1 | P09467 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | MGAM | O43451 | 2/20 | 0.51 |
| ▸ | SI | P14410 | 2/20 | 0.51 |
| ▸ | MGAM2 | Q2M2H8 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | CRHBP | P24387 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28452078 | 0.80 | MAPK1 (0.56) | PTPN11GAAFBP1ALDH1A1KDM4E | |
| SCHEMBL10535557 | 0.76 | FBP1 (0.72) | GAAFBP1ALDH1A1KDM4EMGAM | |
| SCHEMBL5401241 | 0.76 | NR4A2 (0.50) | FBP1KDM4EMAPK1PKMPAX8 | |
| SCHEMBL27982929 | 0.74 | CRHBP (0.75) | GAAFBP1ALDH1A1KDM4EMGAM | |
| SCHEMBL3165346 | 0.72 | ITGB2 (0.72) | ITGB2ICAM1ITGALALDH1A1KDM4E | |
| SCHEMBL7610324 | 0.70 | ITGB2 (0.96) | ITGB2ICAM1ITGALALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL7637698 | 0.68 | ITGB2 (1.00) | ITGB2ICAM1ITGALALDH1A1KDM4E | |
| SCHEMBL1810908 | 0.68 | MAPK1 (0.43) | ICAM1GAAFBP1MAPK1PKM | |
| SCHEMBL7610935 | 0.68 | ITGB2 (0.61) | ITGB2ICAM1ITGALALDH1A1KDM4E | |
| SCHEMBL3434993 | 0.68 | ALDH1A1 (1.00) | GAAALDH1A1KDM4EMGAMSI |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107602548-B | Myricetin derivative containing amide thioether thiadiazole, preparation method and application | 贵州大学 | 2020-09-01 | — | — | CN | disclosed |