Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | FKBP1A | P62942 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA3 | P07451 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA6 | P23280 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8039013 | 0.88 | ALDH1A1 (0.41) | POLBALDH1A1KMT2AMEN1TRPV1 | |
| SCHEMBL8031648 | 0.80 | SMN1; SMN2 (0.52) | ALDH1A1KMT2AMEN1LMNAMAPT | |
| SCHEMBL8035102 | 0.79 | POLB (0.50) | POLBALDH1A1KMT2AMEN1TSHR | |
| SCHEMBL8038657 | 0.76 | POLB (0.40) | POLBALDH1A1KMT2AMEN1MAPT | |
| SCHEMBL8025473 | 0.74 | HSP90AA1 (0.37) | ALDH1A1KMT2AMEN1TSHRHSP90AA1 | |
| SCHEMBL8035119 | 0.74 | KDM4E (0.40) | ALDH1A1KMT2AMEN1HSP90AA1LMNA | |
| SCHEMBL8039002 | 0.73 | MAPT (0.39) | ALDH1A1KMT2AMEN1TSHRHSP90AA1 | |
| SCHEMBL8025474 | 0.72 | TSHR (0.39) | KMT2AMEN1TSHRHSP90AA1LMNA | |
| SCHEMBL8032092 | 0.71 | ALDH1A1 (0.44) | POLBALDH1A1KMT2AMEN1TSHR | |
| SCHEMBL8039016 | 0.71 | HTT (0.42) | ALDH1A1TRPV1HSP90AA1LMNAKDM4E |
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-2009081892-A1 | NOVEL CATECHOL DERIVATIVE, PHARMACEUTICAL COMPOSITION CONTAINING THE SAME, AND USE OF THOSE | KISSEI PHARMACEUTICAL CO., LTD. (JP) | 2009-07-02 | — | — | WO | disclosed |