Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 3/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | CTSL | P07711 | 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 | |
|---|---|---|---|---|
| SCHEMBL11801441 | 0.75 | ALDH1A1 (0.41) | ALDH1A1MAPTRAB9ANPC1HTR2A | |
| SCHEMBL6645015 | 0.68 | RAB9A (0.61) | ALDH1A1MAPTTDP1RAB9ANPC1 | |
| SCHEMBL6141208 | 0.66 | HTR2A (0.64) | ALDH1A1MAPTRAB9AHTR2AGAA | |
| SCHEMBL10732801 | 0.64 | HTR2A (0.55) | ALDH1A1MAPTRAB9AHTR2AGAA | |
| SCHEMBL10334788 | 0.64 | RAB9A (0.50) | ALDH1A1MAPTTDP1RAB9ANPC1 | |
| SCHEMBL8716892 | 0.63 | RAB9A (0.61) | ALDH1A1MAPTTDP1RAB9ANPC1 | |
| SCHEMBL6151831 | 0.63 | RAB9A (0.61) | ALDH1A1MAPTTDP1RAB9ANPC1 | |
| SCHEMBL37664 | 0.63 | HTR2A (0.62) | ALDH1A1RAB9AHTR2AAKR1C3HTT | |
| SCHEMBL11200759 | 0.63 | RAB9A (0.54) | ALDH1A1MAPTTDP1RAB9ANPC1 | |
| SCHEMBL8530085 | 0.62 | HTR2A (0.56) | ALDH1A1MAPTRAB9AHTR2AGAA |
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 |
|---|---|---|---|---|---|---|---|
| US-3962224-A | CHEMICAL INTERMEDIATES FOR ANTIBIOTICS | MERCK & CO., INC. (US) | 1976-06-08 | — | — | US | disclosed |