Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.59 |
| ▸ | LMNA | P02545 | 6/20 | 0.59 |
| ▸ | GAA | P10253 | 4/20 | 0.59 |
| ▸ | HPGD | P15428 | 3/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | MMP13 | P45452 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | POLB | P06746 | 3/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | ALOX12 | P18054 | 3/20 | 0.49 |
| ▸ | ALPL | P05186 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | FBP1 | P09467 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL19278123 | 0.84 | ALDH1A1 (0.50) | ALDH1A1LMNAGAAHPGDMEN1 | |
| SCHEMBL30190006 | 0.82 | MMP13 (0.60) | ALDH1A1HPGDKMT2AMMP13KDM4E | |
| SCHEMBL171282 | 0.82 | MMP13 (0.60) | ALDH1A1HPGDKMT2AMMP13KDM4E | |
| SCHEMBL19277813 | 0.81 | MEN1 (0.60) | ALDH1A1LMNAGAAHPGDMEN1 | |
| SCHEMBL20496880 | 0.80 | ALDH1A1 (0.56) | ALDH1A1LMNAGAAHPGDMEN1 | |
| SCHEMBL22745866 | 0.80 | MMP13 (0.50) | ALDH1A1HPGDMMP13KDM4EHSD17B10 | |
| SCHEMBL1684294 | 0.77 | MMP13 (0.62) | ALDH1A1HPGDMMP13KDM4EHSD17B10 | |
| SCHEMBL1434369 | 0.77 | SMN1; SMN2 (0.60) | ALDH1A1LMNAHPGDMEN1KMT2A | |
| SCHEMBL12069264 | 0.76 | POLB (0.78) | ALDH1A1LMNAGAAHPGDMEN1 | |
| SCHEMBL349644 | 0.76 | ALDH1A1 (0.56) | ALDH1A1LMNAGAAHPGDMEN1 |
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-2017143230-A1 | ANTIFUNGAL COMPOUNDS AND USES THEREOF | DANA-FARBER CANCER INSTITUTE, INC. (US) | 2017-08-24 | — | — | WO | disclosed |