Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | YTHDC1 | Q96MU7 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | CASP1 | P29466 | 3/20 | 0.34 |
| ▸ | CASP7 | P55210 | 3/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.34 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 2/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7335431 | 0.99 | YTHDC1 (0.40) | YTHDC1ADORA3ADORA2ACYP1A2ALDH1A1 | |
| SCHEMBL1388102 | 0.74 | YTHDC1 (0.41) | YTHDC1MAPK14CTSL | |
| Hydrochloric Acid SCHEMBL7742137 | 0.73 | YTHDC1 (0.40) | YTHDC1MAPK14CTSL | |
| SCHEMBL1388188 | 0.73 | ADORA2A (0.39) | ADORA2AALDH1A1KDM4ECTSLADORA1 | |
| SCHEMBL1388038 | 0.71 | ADORA2A (0.41) | ADORA2ACYP1A2ALDH1A1KDM4ECTSL | |
| Hydrochloric Acid SCHEMBL7326920 | 0.70 | ADORA2A (0.40) | ADORA2ACYP1A2ALDH1A1KDM4ECTSL | |
| SCHEMBL8978388 | 0.70 | ALDH1A1 (0.37) | ADORA3ADORA2ACYP1A2ALDH1A1CASP1 | |
| Hydrochloric Acid SCHEMBL27338760 | 0.69 | ALDH1A1 (0.37) | ADORA3ADORA2ACYP1A2ALDH1A1CASP1 | |
| SCHEMBL1388168 | 0.69 | CTSL (0.39) | ADORA2ACYP1A2ALDH1A1KDM4ECTSL | |
| SCHEMBL1387903 | 0.68 | ALDH1A1 (0.43) | YTHDC1ADORA2AALDH1A1CTSLADORA1 |
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-0705265-A1 | NOVEL CHEMICAL COMPOUNDS HAVING PDE-IV INHIBITION ACTIVITY | Euroceltique S.A. (LU) | 1996-04-10 | — | — | EP | disclosed |