Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.58 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | MAOA | P21397 | 1/20 | 0.57 |
| ▸ | MAOB | P27338 | 1/20 | 0.57 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.57 |
| ▸ | PIM1 | P11309 | 1/20 | 0.56 |
| ▸ | ELANE | P08246 | 8/20 | 0.55 |
| ▸ | CTSG | P08311 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11432952 | 0.91 | MEN1 (0.72) | EGFRMEN1KMT2AMAOAMAOB | |
| SCHEMBL28440561 | 0.89 | EGFR (0.52) | EGFRMEN1KMT2APIM1ELANE | |
| SCHEMBL9878218 | 0.87 | EGFR (0.54) | EGFRMEN1KMT2APIM1ELANE | |
| SCHEMBL15413506 | 0.85 | ELANE (0.53) | EGFRMEN1KMT2APIM1ELANE | |
| SCHEMBL7458145 | 0.84 | MEN1 (0.55) | EGFRMEN1KMT2AMAOAMAOB | |
| SCHEMBL9877341 | 0.83 | EGFR (0.48) | EGFRMEN1KMT2APIM1ELANE | |
| SCHEMBL9879835 | 0.83 | EGFR (0.48) | EGFRMEN1KMT2APIM1ELANE | |
| SCHEMBL11238730 | 0.82 | TTR (0.67) | EGFRMEN1KMT2AMAOAMAOB | |
| SCHEMBL9877590 | 0.81 | ELANE (0.51) | EGFRMEN1KMT2APIM1ELANE | |
| SCHEMBL9877831 | 0.81 | HTR1A (0.50) | EGFRMEN1KMT2APIM1ELANE |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111592479-B | Aloe-emodin nitrogen heterocyclic derivative and preparation method and application thereof | 四川大学华西医院 | 2021-10-19 | — | — | CN | disclosed |
| CN-111592479-A | Aloe-emodin nitrogen heterocyclic derivative and preparation method and application thereof | 四川大学华西医院 | 2020-08-28 | — | — | CN | disclosed |
| US-5480873-A | ARTHRITIS | LILLY INDUSTRIES LIMITED (GB) | 1996-01-02 | — | — | US | disclosed |
| CN-1079732-A | Medical compounds | LILLY INDUSTRIES LTD (GB) | 1993-12-22 | — | — | CN | disclosed |
| EP-0570091-A1 | Anthraquinone derivatives, process for their preparation and their use as medicaments | LILLY INDUSTRIES LIMITED (GB) | 1993-11-18 | — | — | EP | disclosed |