Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | CASP7 | P55210 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.30 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Triphenylene SCHEMBL5429154 | 0.82 | KDM4E (0.30) | CYP3A4CASP1CASP7SMN1; SMN2ALDH1A1 | |
| Naphthalene SCHEMBL27561595 | 0.82 | CYP2A6 (0.38) | — | |
| Biphenyl SCHEMBL27460490 | 0.80 | ALDH1A1 (0.41) | CYP3A4SMN1; SMN2ALDH1A1NPC1RAB9A | |
| Anthracene SCHEMBL27342982 | 0.78 | ALDH1A1 (0.32) | ALOX15CYP3A4CASP1CASP7ALDH1A1 | |
| Benzene SCHEMBL27406391 | 0.78 | — | — | |
| SCHEMBL1956229 | 0.78 | — | — | |
| SCHEMBL11025 | 0.78 | — | — | |
| SCHEMBL27966808 | 0.78 | — | — | |
| Toluene SCHEMBL28621404 | 0.77 | LMNA (0.46) | SMN1; SMN2TSHRNPC1RAB9A | |
| Hydroxyamine SCHEMBL28563497 | 0.76 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112341446-B | Immunomodulator | 成都先导药物开发股份有限公司 | 2022-06-17 | — | — | CN | disclosed |
| CN-112341446-A | Immunomodulator | 成都先导药物开发股份有限公司 | 2021-02-09 | — | — | CN | disclosed |