Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 13/20 | 0.69 |
| ▸ | AKR1C2 | P52895 | 13/20 | 0.69 |
| ▸ | NPC1 | O15118 | 3/20 | 0.57 |
| ▸ | RAB9A | P51151 | 3/20 | 0.57 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | GAA | P10253 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | THRB | P10828 | 1/20 | 0.55 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.55 |
| ▸ | RECQL | P46063 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL11538185 | 0.83 | ALDH1A1 (0.56) | AKR1C3AKR1C2NPC1RAB9ANPSR1 | |
| SCHEMBL2874491 | 0.82 | KDM4E (0.67) | AKR1C3AKR1C2NPC1RAB9ANPSR1 | |
| SCHEMBL9595058 | 0.81 | AKR1C3 (1.00) | AKR1C3AKR1C2MAPTMEN1LMNA | |
| SCHEMBL1415572 | 0.81 | AKR1C3 (0.82) | AKR1C3AKR1C2NPC1RAB9ANPSR1 | |
| SCHEMBL5693236 | 0.79 | SMN1; SMN2 (0.57) | AKR1C3AKR1C2NPC1RAB9AALDH1A1 | |
| SCHEMBL16862294 | 0.79 | MAPT (0.56) | AKR1C3AKR1C2NPC1RAB9ANPSR1 | |
| SCHEMBL9593627 | 0.78 | MEN1 (0.83) | AKR1C3AKR1C2MAPTMEN1LMNA | |
| SCHEMBL355486 | 0.78 | AKR1C3 (0.72) | AKR1C3AKR1C2NPC1RAB9ANPSR1 | |
| SCHEMBL30213377 | 0.78 | AKR1C3 (0.72) | AKR1C3AKR1C2NPC1RAB9ANPSR1 | |
| SCHEMBL5442673 | 0.78 | CA1 (0.77) | AKR1C3AKR1C2NPC1RAB9ANPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0751105-A2 | Process for the oxidation of organic compounds | BAYER AG (DE) | 1997-01-02 | — | — | EP | disclosed |
| EP-0363756-A2 | Method for the preparation of 2,5-diarylamino-terephthalic acids | BAYER AG (DE) | 1990-04-18 | — | — | EP | disclosed |