Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.52 |
| ▸ | HTT | P42858 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | POLB | P06746 | 3/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | PYGL | P06737 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.46 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2088259 | 0.83 | ALDH1A1 (0.64) | ALDH1A1HTTMAPTPOLBKDM4E | |
| SCHEMBL9663782 | 0.82 | ALDH1A1 (0.46) | ALDH1A1HTTMAPTPOLBKDM4E | |
| SCHEMBL6354556 | 0.80 | ALDH1A1 (0.59) | ALDH1A1HTTMAPTPOLBKDM4E | |
| SCHEMBL11656857 | 0.79 | ALDH1A1 (0.47) | ALDH1A1HTTMAPTPOLBKDM4E | |
| SCHEMBL9768609 | 0.79 | ALDH1A1 (0.57) | ALDH1A1HTTMAPTPOLBKDM4E | |
| SCHEMBL10700547 | 0.77 | GLA (0.45) | ALDH1A1HTTMAPTPOLBKDM4E | |
| SCHEMBL8651201 | 0.77 | ALDH1A1 (0.55) | ALDH1A1HTTMAPTPOLBKDM4E | |
| SCHEMBL1851780 | 0.76 | SMN1; SMN2 (0.68) | ALDH1A1HTTMAPTPOLBKDM4E | |
| SCHEMBL30492996 | 0.76 | SMN1; SMN2 (0.68) | ALDH1A1HTTMAPTPOLBKDM4E | |
| SCHEMBL31173254 | 0.76 | ALDH1A1 (0.54) | ALDH1A1HTTMAPTPOLBKDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115044226-A | 3-amino-5-nitrobenzoisothiazole-based dye and preparation method thereof | 金塔县晋泰森新材料科技有限公司 | 2022-09-13 | — | — | CN | claimed |
| CN-106752080-B | Disperse dye composition and preparation method and application thereof | 浙江闰土研究院有限公司 | 2020-09-01 | — | — | CN | disclosed |
| CN-106800798-B | Disperse dye composition and preparation method and application thereof | 浙江闰土研究院有限公司 | 2019-12-06 | — | — | CN | disclosed |