Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ERN1 | O75460 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.34 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 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 | |
|---|---|---|---|---|
| SCHEMBL27772408 | 0.77 | HSD17B10 (0.55) | ALDH1A1HTR2A | |
| SCHEMBL5679303 | 0.73 | CA2 (0.61) | CA2SMN1; SMN2 | |
| Phosphine SCHEMBL29104339 | 0.73 | CYP1A2 (0.40) | CA2CYP3A4USP2MAPK1SMN1; SMN2 | |
| SCHEMBL27772412 | 0.73 | CA2 (0.53) | CA2MAPK1SMN1; SMN2ALDH1A1 | |
| SCHEMBL5238331 | 0.73 | HTR2A (0.33) | HTR2AHTR2CHTR2B | |
| Ammonia Solution, Strong SCHEMBL28500084 | 0.72 | CA2 (0.59) | CA2SMN1; SMN2 | |
| SCHEMBL20478039 | 0.72 | IDO1 (0.53) | CA2CYP1A2 | |
| SCHEMBL21472948 | 0.71 | CA2 (0.42) | CA2CYP3A4MAPK1CYP1A2CYP2C19 | |
| SCHEMBL1713657 | 0.71 | ALDH1A1 (0.48) | CA2CYP1A2ALDH1A1CYP1A1CYP1B1 | |
| SCHEMBL20478018 | 0.71 | IDO1 (0.50) | CA2SMN1; SMN2ALDH1A1 |
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-116854552-A | Polysubstituted olefin and preparation method thereof | 苏州华道生物药业股份有限公司 | 2023-10-10 | — | — | CN | disclosed |