Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRAP1 | Q12931 | 7/20 | 0.56 |
| ▸ | HSP90B1 | P14625 | 5/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | CA12 | O43570 | 1/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.54 |
| ▸ | CA2 | P00918 | 1/20 | 0.54 |
| ▸ | CA7 | P43166 | 1/20 | 0.54 |
| ▸ | CA9 | Q16790 | 1/20 | 0.54 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.54 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.53 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.53 |
| ▸ | PBRM1 | Q86U86 | 1/20 | 0.51 |
| ▸ | HSP90AA1 | P07900 | 5/20 | 0.51 |
| ▸ | HSP90AB1 | P08238 | 5/20 | 0.51 |
| ▸ | NAMPT | P43490 | 2/20 | 0.50 |
| ▸ | MGLL | Q99685 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL17618301 | 0.88 | TRAP1 (0.65) | TRAP1HSP90B1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL1947639 | 0.80 | TRAP1 (0.56) | TRAP1HSP90B1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL12569373 | 0.80 | HPGD (0.64) | TRAP1HSP90B1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL4167985 | 0.80 | NAMPT (0.64) | TRAP1HSP90B1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL15271489 | 0.79 | CA12 (0.64) | ALDH1A1HPGDSMN1; SMN2CA12CA1 | |
| SCHEMBL1877596 | 0.79 | KDM4E (0.68) | ALDH1A1HPGDSMN1; SMN2CA12CA1 | |
| SCHEMBL520565 | 0.79 | CA12 (0.63) | ALDH1A1HPGDCA12CA1CA2 | |
| Hydrochloric Acid SCHEMBL7128756 | 0.78 | KDM4E (0.66) | ALDH1A1HPGDSMN1; SMN2CA12CA1 | |
| SCHEMBL7090972 | 0.78 | HPGD (0.66) | ALDH1A1HPGDSMN1; SMN2CA12CA1 | |
| Hydrochloric Acid SCHEMBL10437647 | 0.78 | CA12 (0.62) | ALDH1A1HPGDCA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012001107-A1 | PIPERIDINE DERIVATIVES AND THEIR USE FOR THE TREATMENT OF METABOLIC DISORDERS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2012-01-05 | — | — | WO | disclosed |