Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.57 |
| ▸ | LMNA | P02545 | 4/20 | 0.57 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | RECQL | P46063 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.52 |
| ▸ | MEN1 | O00255 | 5/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.48 |
| ▸ | NTRK2 | Q16620 | 1/20 | 0.48 |
| ▸ | FLT3 | P36888 | 8/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.47 |
| ▸ | RAB9A | P51151 | 4/20 | 0.47 |
| ▸ | CFTR | P13569 | 2/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3789990 | 0.98 | ALDH1A1 (0.59) | ALDH1A1LMNAMAPTRECQLKMT2A | |
| SCHEMBL3395973 | 0.85 | ALDH1A1 (0.74) | ALDH1A1LMNAMAPTRECQLKMT2A | |
| SCHEMBL3397806 | 0.83 | ALDH1A1 (0.77) | ALDH1A1LMNAMAPTRECQLKMT2A | |
| SCHEMBL3795995 | 0.82 | NTRK1 (0.50) | ALDH1A1LMNAMAPTRECQLKMT2A | |
| SCHEMBL3789171 | 0.80 | NTRK1 (0.52) | ALDH1A1LMNAMAPTRECQLKMT2A | |
| SCHEMBL3396603 | 0.79 | SMN1; SMN2 (0.76) | ALDH1A1LMNAMAPTRECQLKMT2A | |
| SCHEMBL3395315 | 0.77 | ALDH1A1 (0.76) | ALDH1A1LMNAMAPTRECQLKMT2A | |
| SCHEMBL3398710 | 0.74 | SMN1; SMN2 (0.58) | ALDH1A1LMNAMAPTRECQLKMT2A | |
| SCHEMBL3398841 | 0.72 | SMN1; SMN2 (0.56) | ALDH1A1LMNAMAPTRECQLKMT2A | |
| SCHEMBL3397102 | 0.72 | L3MBTL1 (0.67) | ALDH1A1LMNAMAPTKMT2AMEN1 |
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-2010098866-A1 | CYCLOPENTATHIOPHENE/CYCLOHEXATHIOPHENE DNA METHYLTRANSFERASE INHIBITORS | SUPERGEN, INC. (US) | 2010-09-02 | — | — | WO | claimed |
| WO-2010098866-A1 | CYCLOPENTATHIOPHENE/CYCLOHEXATHIOPHENE DNA METHYLTRANSFERASE INHIBITORS | SUPERGEN, INC. (US) | 2010-09-02 | — | — | WO | disclosed |