Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | TGM2 | P21980 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 5/20 | 0.49 |
| ▸ | CA2 | P00918 | 5/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | GSK3B | P49841 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | PLK1 | P53350 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.45 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL1490910 | 0.81 | CES2 (0.52) | PKMTGM2CA1CA2MAPT | |
| SCHEMBL9176959 | 0.80 | ALDH1A1 (0.49) | CA1CA2MAPTGSK3BALDH1A1 | |
| SCHEMBL2731511 | 0.80 | ALDH5A1 (0.52) | PKMCA1CA2MAPTALDH1A1 | |
| SCHEMBL498487 | 0.78 | MEN1 (0.54) | PKMCA1CA2MAPTGSK3B | |
| SCHEMBL2019776 | 0.75 | CA1 (0.61) | CA1CA2MAPTCES2CES1 | |
| SCHEMBL31119870 | 0.74 | HDAC3 (0.61) | PKMTGM2CA1CA2MAPT | |
| SCHEMBL9574425 | 0.74 | PDE4A (0.62) | CA1CA2MAPTCES2CES1 | |
| SCHEMBL1672224 | 0.74 | KDM4E (0.63) | MAPTALDH1A1KDM4E | |
| SCHEMBL546672 | 0.73 | F3 (0.59) | PKMTGM2CA1CA2MAPT | |
| SCHEMBL3152379 | 0.73 | HTT (0.58) | PKMTGM2MAPTALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| EP-2887929-A2 | COMPOUNDS FOR PREVENTING, REDUCING AND/OR ALLEVIATING ITCHY SKIN CONDITION(S) | Symrise AG (DE) | 2015-07-01 | — | — | EP | disclosed |
| WO-2012143576-A2 | COMPOUNDS FOR PREVENTING, REDUCING AND/OR ALLEVIATING ITCHY SKIN CONDITION(S) | SYMRISE AG (DE) | 2012-10-26 | — | — | WO | disclosed |