Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.59 |
| ▸ | DDIT3 | P35638 | 8/20 | 0.57 |
| ▸ | RAB9A | P51151 | 4/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.57 |
| ▸ | MITF | O75030 | 3/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | CSF1R | P07333 | 1/20 | 0.47 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 3/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL5322339 | 0.74 | ALDH1A1 (1.00) | ALDH1A1DDIT3RAB9AMAPTKMT2A | |
| SCHEMBL16919773 | 0.73 | DDIT3 (1.00) | ALDH1A1DDIT3RAB9AMAPTKMT2A | |
| SCHEMBL8896530 | 0.70 | ALDH1A1 (0.58) | ALDH1A1MAPTKMT2ASMN1; SMN2MEN1 | |
| SCHEMBL11455980 | 0.70 | LMNA (0.56) | ALDH1A1RAB9AMAPTKMT2AMITF | |
| SCHEMBL12261479 | 0.70 | LMNA (0.53) | ALDH1A1RAB9AMAPTKMT2AMITF | |
| SCHEMBL6427316 | 0.69 | RAB9A (0.74) | ALDH1A1DDIT3RAB9AMAPTKMT2A | |
| SCHEMBL6203436 | 0.69 | ATM (0.46) | ALDH1A1MAPTKMT2ANPC1GAA | |
| SCHEMBL11790220 | 0.69 | LMNA (0.51) | ALDH1A1RAB9AMAPTKMT2AMITF | |
| Nifurmerone SCHEMBL398798 | 0.69 | LMNA (0.51) | ALDH1A1RAB9AMAPTKMT2AMITF | |
| SCHEMBL4186870 | 0.69 | LMNA (0.65) | ALDH1A1MAPTKMT2ASMN1; SMN2GAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1501830-A1 | 7-ARYL-3,9-DIAZABICYCLO[3.3.1]NON-6-ENE DERIVATIVES AND THEIR USE AS RENIN INHIBITORS IN THE TREATMENT OF HYPERTENSION, CARDIOVASCULAR OR RENAL DISEASES | Actelion Pharmaceuticals Ltd. (CH) | 2005-02-02 | — | — | EP | claimed |
| WO-2003093267-A1 | 7-ARYL-3,9-DIAZABICYCLO(3.3.1)NON-6-ENE DERIVATIVES AND THEIR USE AS RENIN INHIBITORS IN THE TREATMENT OF HYPERTENSION, CARDIOVASCULAR OR RENAL DISEASES | ACTELION PHARMACEUTICALS LTD (CH) | 2003-11-13 | — | — | WO | claimed |
| US-20050272036-A1 | Ketones | ASTRAZENECA AB (SE) | 2005-12-08 | — | — | US | disclosed |