Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.51 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | PLAAT3 | P53816 | 1/20 | 0.46 |
| ▸ | PLAAT5 | Q96KN8 | 1/20 | 0.46 |
| ▸ | PLAAT2 | Q9NWW9 | 1/20 | 0.46 |
| ▸ | PLAAT4 | Q9UL19 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 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 | |
|---|---|---|---|---|
| SCHEMBL2857856 | 0.92 | TSHR (0.49) | ALDH1A1MAPTCA12CA1CA2 | |
| SCHEMBL2854891 | 0.91 | ABCB1 (0.52) | ALDH1A1CA12CA1CA2CA9 | |
| SCHEMBL2854586 | 0.88 | ALDH1A1 (0.47) | ALDH1A1MAPTHTTKMT2AHPGD | |
| SCHEMBL2859644 | 0.88 | ALDH1A1 (0.43) | ALDH1A1MAPTKMT2ATP53HPGD | |
| SCHEMBL2859429 | 0.88 | NPC1 (0.46) | ALDH1A1MAPTHTTKMT2AHPGD | |
| SCHEMBL2854509 | 0.87 | KDM4E (0.50) | ALDH1A1MAPTCA12CA2CA9 | |
| SCHEMBL2852955 | 0.87 | KDM4E (0.44) | ALDH1A1MAPTHTTKMT2AHPGD | |
| SCHEMBL2859726 | 0.87 | ALDH1A1 (0.46) | ALDH1A1MAPTHTTKMT2ATP53 | |
| SCHEMBL2860826 | 0.86 | KDM4E (0.43) | ALDH1A1MAPTPLAAT3PLAAT5PLAAT2 | |
| SCHEMBL2854716 | 0.86 | MTNR1A (0.47) | ALDH1A1MAPTHTTKMT2ATP53 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1451160-B1 | PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN | ICAGEN INC (US) | 2010-01-13 | — | — | EP | claimed |