Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | GAA | P10253 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.35 |
| ▸ | CDC42BPA | Q5VT25 | 1/20 | 0.35 |
| ▸ | CDC42BPB | Q9Y5S2 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL15388910 | 0.84 | TSHR (0.41) | ALDH1A1GAAKDM4EMAPTL3MBTL1 | |
| SCHEMBL16952724 | 0.77 | TSHR (0.50) | ALDH1A1GAAL3MBTL1TSHRLMNA | |
| SCHEMBL7508041 | 0.77 | AR (0.43) | ALDH1A1GAAKDM4EMAPTL3MBTL1 | |
| SCHEMBL16952933 | 0.76 | GAA (0.34) | ALDH1A1GAAKDM4EL3MBTL1HTT | |
| SCHEMBL16054616 | 0.76 | CYP11B1 (0.40) | ALDH1A1GAAKDM4EMAPTL3MBTL1 | |
| SCHEMBL16954482 | 0.76 | GAA (0.35) | ALDH1A1GAAKDM4EMAPTL3MBTL1 | |
| SCHEMBL29122661 | 0.76 | DYRK1A (0.38) | ALDH1A1GAAKDM4EMAPTL3MBTL1 | |
| SCHEMBL30602897 | 0.76 | L3MBTL1 (0.48) | ALDH1A1GAAKDM4EMAPTL3MBTL1 | |
| SCHEMBL16952722 | 0.76 | GAA (0.35) | ALDH1A1GAAKDM4EL3MBTL1HTT | |
| SCHEMBL28252549 | 0.75 | ALDH1A1 (0.42) | ALDH1A1GAAKDM4EMAPTL3MBTL1 |
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-1377556-A1 | PYRAZOLE DERIVATIVES FOR TREATING HIV | Pfizer Limited (GB) | 2004-01-07 | — | — | EP | claimed |
| WO-2002085860-A1 | PYRAZOLE DERIVATIVES FOR TREATING HIV | PFIZER LIMITED (GB) | 2002-10-31 | — | — | WO | claimed |