Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.36 |
| ▸ | HPGDS | O60760 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.35 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.35 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | ELANE | P08246 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11227122 | 0.67 | ALDH1A1 (0.39) | ALDH1A1HPGDRAB9ANPC1MEN1 | |
| Benzophenone SCHEMBL6662205 | 0.65 | ALDH1A1 (0.82) | ALDH1A1HPGDRAB9ANPC1MEN1 | |
| Benzophenone SCHEMBL31633934 | 0.65 | ALDH1A1 (0.93) | ALDH1A1HPGDRAB9ANPC1MEN1 | |
| SCHEMBL18807683 | 0.64 | SMN1; SMN2 (0.47) | ALDH1A1HPGDRAB9ANPC1MEN1 | |
| SCHEMBL23059722 | 0.63 | TDP1 (0.40) | ALDH1A1HPGDRAB9ANPC1MEN1 | |
| Benzophenone SCHEMBL7454682 | 0.63 | ALDH1A1 (0.88) | ALDH1A1HPGDRAB9ANPC1MEN1 | |
| Benzophenone SCHEMBL6061130 | 0.62 | ALDH1A1 (1.00) | ALDH1A1HPGDRAB9ANPC1MEN1 | |
| Benzophenone SCHEMBL30537001 | 0.62 | ALDH1A1 (1.00) | ALDH1A1HPGDRAB9ANPC1MEN1 | |
| Benzophenone SCHEMBL30536983 | 0.62 | ALDH1A1 (1.00) | ALDH1A1HPGDRAB9ANPC1MEN1 | |
| Benzophenone SCHEMBL28491203 | 0.62 | ALDH1A1 (1.00) | ALDH1A1HPGDRAB9ANPC1MEN1 |
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-2012029942-A1 | CYCLIC AMIDE DERIVATIVE | 大日本住友製薬株式会社 (JP) | 2012-03-08 | — | — | WO | disclosed |