Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | TOP2A | P11388 | 1/20 | 0.43 |
| ▸ | TOP2B | Q02880 | 1/20 | 0.43 |
| ▸ | DGAT1 | O75907 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.36 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.36 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | GCGR | P47871 | 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 | |
|---|---|---|---|---|
| SCHEMBL27399146 | 0.81 | ALDH1A1 (0.49) | MAPTSMN1; SMN2LMNADGAT1CYP1A2 | |
| SCHEMBL7013819 | 0.81 | DGAT1 (0.41) | LMNATOP2ATOP2BDGAT1CYP1A2 | |
| SCHEMBL31392405 | 0.80 | ATM (0.46) | CYP1A2CYP3A4CYP2C19CYP2D6MAPK1 | |
| SCHEMBL9046762 | 0.74 | MEN1 (0.68) | MAPTLMNAGAACYP1A2CYP3A4 | |
| SCHEMBL15023022 | 0.73 | MAPK9 (0.59) | SMN1; SMN2LMNATOP2ATOP2BKMT2A | |
| SCHEMBL999683 | 0.71 | MAPT (0.50) | MAPTSMN1; SMN2LMNADGAT1GAA | |
| SCHEMBL9140635 | 0.69 | CDC25B (0.33) | CDC25B | |
| SCHEMBL28209270 | 0.68 | ATM (0.46) | MAPTSMN1; SMN2GAAMAPK1TP53 | |
| SCHEMBL29460951 | 0.68 | — | — | |
| SCHEMBL1344036 | 0.68 | — | — |
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-104311492-B | The preparation method that a kind of ACT-064992 intermediate is new | 成都克莱蒙医药科技有限公司 | 2016-08-24 | — | — | CN | disclosed |