Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VCAM1 | P19320 | 5/20 | 0.38 |
| ▸ | IKBKB | O14920 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | GRM6 | O15303 | 1/20 | 0.33 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.33 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.33 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.33 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.33 |
| ▸ | XDH | P47989 | 1/20 | 0.33 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | XBP1 | P17861 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1629347 | 0.74 | ALDH1A1 (0.42) | VCAM1ALDH1A1TDP1GRM6GRIA1 | |
| SCHEMBL31288050 | 0.68 | S1PR4 (0.44) | ALDH1A1TDP1S1PR4MAPTPOLB | |
| SCHEMBL2307443 | 0.68 | S1PR4 (0.44) | ALDH1A1TDP1S1PR4MAPTPOLB | |
| SCHEMBL31569503 | 0.68 | ALDH1A1 (0.40) | ALDH1A1TDP1S1PR4MAPTHPGD | |
| SCHEMBL4759212 | 0.68 | VCAM1 (0.49) | VCAM1ALDH1A1TDP1GRM6GRIA1 | |
| SCHEMBL18462460 | 0.67 | ALDH1A1 (0.47) | ALDH1A1TDP1MAPTHPGDNPC1 | |
| SCHEMBL29462393 | 0.67 | ALDH1A1 (0.47) | ALDH1A1TDP1MAPTHPGDNPC1 | |
| SCHEMBL260778 | 0.67 | ALDH1A1 (0.47) | ALDH1A1TDP1MAPTHPGDNPC1 | |
| SCHEMBL6385999 | 0.65 | ALDH1A1 (0.49) | ALDH1A1TDP1MAPK1MAPTNPC1 | |
| SCHEMBL3016976 | 0.65 | VCAM1 (0.48) | VCAM1ALDH1A1TDP1GRM6GRIA1 |
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-1979351-A1 | 6-PHENYL-1H-IMIDAZO[4, 5-C]PYRIDINE-4-CARBONITRILE DERIVATIVES AS CATHEPSIN K AND S INHIBITORS | N.V. Organon (NL) | 2008-10-15 | — | — | EP | disclosed |
| WO-2007080191-A1 | 6-PHENYL-1H-IMIDAZO[4, 5-C]PYRIDINE-4-CARBONITRILE DERIVATIVES AS CATHEPSIN K AND S INHIBITORS | N.V. ORGANON (NL) | 2007-07-19 | — | — | WO | disclosed |