Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
| ▸ | GRM5 | P41594 | 5/20 | 0.49 |
| ▸ | MLYCD | O95822 | 1/20 | 0.48 |
| ▸ | MGLL | Q99685 | 1/20 | 0.46 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.45 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.45 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6827806 | 0.88 | ALDH1A1 (0.58) | ALDH1A1HPGDHSD17B10KDM4EPOLB | |
| SCHEMBL6827736 | 0.86 | SMN1; SMN2 (0.54) | ALDH1A1HPGDHSD17B10KDM4EPOLB | |
| SCHEMBL6825039 | 0.86 | ALDH1A1 (0.56) | ALDH1A1HPGDHSD17B10KDM4EPOLB | |
| SCHEMBL6829789 | 0.85 | ALDH1A1 (0.53) | ALDH1A1HPGDHSD17B10KDM4EPOLB | |
| SCHEMBL3229607 | 0.83 | ALDH1A1 (0.57) | ALDH1A1HPGDHSD17B10KDM4EPOLB | |
| SCHEMBL6825133 | 0.82 | ALDH1A1 (0.49) | ALDH1A1HPGDHSD17B10KDM4EPOLB | |
| SCHEMBL13092177 | 0.82 | ALDH1A1 (0.47) | ALDH1A1HPGDHSD17B10KDM4EPOLB | |
| SCHEMBL6825339 | 0.80 | ALDH1A1 (0.56) | ALDH1A1HPGDHSD17B10KDM4EPOLB | |
| SCHEMBL6925899 | 0.79 | ALDH1A1 (0.55) | ALDH1A1HPGDHSD17B10KDM4EPOLB | |
| Hydrochloric Acid SCHEMBL6828593 | 0.78 | ALDH1A1 (0.54) | ALDH1A1HPGDHSD17B10KDM4EPOLB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004074273-A1 | NOVEL COMPOUNDS | ASTRAZENECA AB (SE) | 2004-09-02 | — | — | WO | claimed |
| WO-2004074273-A1 | NOVEL COMPOUNDS | ASTRAZENECA AB (SE) | 2004-09-02 | — | — | WO | disclosed |