Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 4/20 | 0.48 |
| ▸ | STING1 | Q86WV6 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PGK1 | P00558 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA4 | P22748 | 1/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL31507657 | 0.88 | TAAR1 (0.42) | APPMAPTALDH1A1SMN1; SMN2MEN1 | |
| SCHEMBL14382356 | 0.86 | SMN1; SMN2 (0.53) | ALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL20038708 | 0.86 | L3MBTL1 (0.48) | APPCYP3A4MAPTALDH1A1HPGD | |
| SCHEMBL28413236 | 0.83 | APP (0.42) | APPSTING1MAPTALDH1A1MEN1 | |
| SCHEMBL14095799 | 0.81 | TAAR1 (0.43) | APPMAPT | |
| SCHEMBL19147590 | 0.79 | MAPT (0.50) | APPCYP3A4MAPTPGK1ALDH1A1 | |
| SCHEMBL22641589 | 0.79 | NQO1 (0.52) | APPMAPTALDH1A1HPGDCA2 | |
| SCHEMBL19815866 | 0.78 | MAPT (0.46) | APPCYP3A4MAPTALDH1A1HPGD | |
| SCHEMBL15986420 | 0.78 | MAPT (0.57) | MAPTALDH1A1SMN1; SMN2MEN1KMT2A | |
| SCHEMBL9191290 | 0.78 | RET (0.40) | APPSTING1CYP3A4MAPTALDH1A1 |
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-113322057-B | Adsorption inhibitor, preparation method and application thereof | 中国石油化工股份有限公司 | 2022-05-24 | — | — | CN | claimed |
| CN-113322057-A | Adsorption inhibitor, preparation method and application thereof | 中国石油化工股份有限公司 | 2021-08-31 | — | — | CN | claimed |
| CN-113322057-B | Adsorption inhibitor, preparation method and application thereof | 中国石油化工股份有限公司 | 2022-05-24 | — | — | CN | disclosed |
| CN-113322057-A | Adsorption inhibitor, preparation method and application thereof | 中国石油化工股份有限公司 | 2021-08-31 | — | — | CN | disclosed |