Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.66 |
| ▸ | MAPT | P10636 | 8/20 | 0.66 |
| ▸ | RAB9A | P51151 | 8/20 | 0.66 |
| ▸ | NPC1 | O15118 | 7/20 | 0.66 |
| ▸ | LMNA | P02545 | 6/20 | 0.66 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.66 |
| ▸ | PKM | P14618 | 1/20 | 0.66 |
| ▸ | TP53 | P04637 | 3/20 | 0.61 |
| ▸ | HPGD | P15428 | 2/20 | 0.61 |
| ▸ | MEN1 | O00255 | 4/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.60 |
| ▸ | CASP3 | P42574 | 1/20 | 0.56 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.56 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL6828818 | 0.84 | KLK7 (0.58) | ALDH1A1MAPTRAB9ANPC1LMNA | |
| SCHEMBL18993430 | 0.81 | KLK7 (0.50) | ALDH1A1MAPTRAB9ANPC1LMNA | |
| SCHEMBL7492014 | 0.80 | RAB9A (0.55) | ALDH1A1MAPTRAB9ANPC1LMNA | |
| SCHEMBL6831061 | 0.78 | MAPT (0.51) | ALDH1A1MAPTRAB9ANPC1LMNA | |
| SCHEMBL29183765 | 0.78 | MAPT (0.50) | ALDH1A1MAPTRAB9ANPC1LMNA | |
| SCHEMBL6829037 | 0.77 | MAPT (0.66) | ALDH1A1MAPTRAB9ANPC1LMNA | |
| SCHEMBL5777694 | 0.77 | SAE1 (0.54) | MAPTRAB9ANPC1LMNAPKM | |
| SCHEMBL6829163 | 0.77 | RAB9A (0.60) | ALDH1A1MAPTRAB9ANPC1LMNA | |
| SCHEMBL16692740 | 0.77 | KLK7 (0.46) | ALDH1A1MAPTRAB9ANPC1LMNA | |
| SCHEMBL6828648 | 0.75 | TERT (0.54) | ALDH1A1MAPTRAB9ANPC1LMNA |
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-2004037808-A1 | 2 - SUBSTITUTED HETEROCYCLIC COMPOUNDS AND ANTITUMOR COMPOSITION COMPRISING THE SAME | CHONG KUN DANG PHARMACEUTICAL CORP. (KR) | 2004-05-06 | — | — | WO | disclosed |