Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | ALDH5A1 | P51649 | 3/20 | 0.46 |
| ▸ | ABAT | P80404 | 3/20 | 0.46 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.46 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.42 |
| ▸ | PTPN1 | P18031 | 6/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | IDH1 | O75874 | 1/20 | 0.38 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.38 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.38 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.38 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30500661 | 0.82 | PTGS2 (0.57) | KDM4EPTGS2RAB9AALDH1A1ALDH5A1 | |
| SCHEMBL2632511 | 0.82 | PTGS2 (0.57) | KDM4EPTGS2RAB9AALDH1A1ALDH5A1 | |
| SCHEMBL27872348 | 0.79 | PTGS2 (0.53) | KDM4EPTGS2RAB9AALDH1A1ALDH5A1 | |
| SCHEMBL13257342 | 0.77 | KDM4E (0.61) | KDM4EPTGS2RAB9AALDH1A1ALDH5A1 | |
| Hydrochloric Acid SCHEMBL18281037 | 0.77 | PTGS2 (0.52) | KDM4EPTGS2RAB9AALDH1A1ALDH5A1 | |
| SCHEMBL12468525 | 0.76 | PTPN1 (0.40) | ALDH1A1PTPN1PDE4DIDH1ABCB1 | |
| SCHEMBL30335079 | 0.74 | PTPN1 (0.63) | RAB9APTPN1IDH1ABCB1UGT1A1 | |
| SCHEMBL856316 | 0.74 | KDM4E (0.57) | KDM4EPTGS2RAB9AALDH1A1ALDH5A1 | |
| SCHEMBL29452390 | 0.74 | KDM4E (0.57) | KDM4EPTGS2RAB9AALDH1A1ALDH5A1 | |
| SCHEMBL7191193 | 0.74 | PTPN1 (0.44) | KDM4EALDH1A1TRIM24TRIM33PTPN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117789993-B | Establishment and application of gastric cancer prediction model based on tongue fur metabolite | 浙江省肿瘤医院 | 2024-06-11 | — | — | CN | claimed |
| CN-117789993-A | Establishment and application of gastric cancer prediction model based on tongue fur metabolite | 浙江省肿瘤医院 | 2024-03-29 | — | — | CN | claimed |
| CN-117789993-B | Establishment and application of gastric cancer prediction model based on tongue fur metabolite | 浙江省肿瘤医院 | 2024-06-11 | — | — | CN | disclosed |
| CN-117789993-A | Establishment and application of gastric cancer prediction model based on tongue fur metabolite | 浙江省肿瘤医院 | 2024-03-29 | — | — | CN | disclosed |