Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.69 |
| ▸ | HPGD | P15428 | 7/20 | 0.69 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.69 |
| ▸ | NPC1 | O15118 | 4/20 | 0.69 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.69 |
| ▸ | RAB9A | P51151 | 3/20 | 0.69 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.69 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.62 |
| ▸ | POLB | P06746 | 3/20 | 0.60 |
| ▸ | GAA | P10253 | 2/20 | 0.60 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.58 |
| ▸ | CASP3 | P42574 | 1/20 | 0.57 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.57 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.57 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | USP2 | O75604 | 1/20 | 0.55 |
| ▸ | SLC18A1 | P54219 | 1/20 | 0.51 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.51 |
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL22632089 | 0.89 | ALDH1A1 (0.67) | ALDH1A1HPGDKDM4ENPC1HSD17B10 | |
| SCHEMBL24623222 | 0.88 | HPGD (0.65) | ALDH1A1HPGDKDM4ENPC1HSD17B10 | |
| SCHEMBL24623218 | 0.86 | ALDH1A1 (0.63) | ALDH1A1HPGDKDM4ENPC1HSD17B10 | |
| SCHEMBL6227542 | 0.85 | ALDH1A1 (0.74) | ALDH1A1HPGDKDM4ENPC1HSD17B10 | |
| SCHEMBL12987100 | 0.82 | ALDH1A1 (1.00) | ALDH1A1HPGDKDM4ENPC1HSD17B10 | |
| SCHEMBL24623271 | 0.78 | POLB (0.53) | ALDH1A1HPGDKDM4ENPC1HSD17B10 | |
| SCHEMBL30228151 | 0.76 | HPGD (0.73) | ALDH1A1HPGDKDM4ENPC1HSD17B10 | |
| SCHEMBL22632088 | 0.74 | SLC18A1 (0.54) | ALDH1A1HPGDKDM4EHSD17B10RXFP1 | |
| SCHEMBL22632087 | 0.73 | CYP2D6 (0.76) | ALDH1A1HPGDKDM4EHSD17B10GAA | |
| SCHEMBL22632227 | 0.73 | SLC18A1 (0.59) | ALDH1A1HPGDKDM4EHSD17B10GAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020223174-A1 | COUMARIN-MODIFIED ANDROGENS FOR THE TREATMENT OF PROSTATE CANCER | HEALTH RESEARCH, INC. (US) | 2020-11-05 | — | — | WO | disclosed |