Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.51 |
| ▸ | CES2 | O00748 | 1/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | PKM | P14618 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
| ▸ | SOX18 | P35713 | 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 | |
|---|---|---|---|---|
| SCHEMBL23832296 | 0.86 | HPGD (0.58) | CES2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL3237723 | 0.81 | RAB9A (0.73) | MEN1KMT2AL3MBTL1NPC1RAB9A | |
| SCHEMBL3240913 | 0.81 | NPC1 (0.69) | NPC1RAB9AMAPTALDH1A1POLB | |
| SCHEMBL2732841 | 0.81 | CYP1A2 (0.58) | CES2PKMMAPTRXFP1CYP1A2 | |
| SCHEMBL5969148 | 0.80 | ESRRG (0.60) | MEN1KMT2AL3MBTL1NPC1RAB9A | |
| SCHEMBL761158 | 0.79 | KDM4E (0.61) | CES2PKMMAPTRXFP1CYP1A2 | |
| SCHEMBL3236338 | 0.78 | HPGD (0.71) | MEN1KMT2AUSP2NPC1RAB9A | |
| SCHEMBL3240006 | 0.77 | CES2 (0.66) | TAAR1CES2MEN1KMT2ANPC1 | |
| SCHEMBL13652571 | 0.77 | MTNR1A (0.62) | CES2PKMMAPTRXFP1KDM4E | |
| SCHEMBL3225747 | 0.76 | RAB9A (0.64) | MEN1KMT2AUSP2NPC1RAB9A |
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-2010022355-A1 | COMPOUNDS AND METHODS FOR TREATING RESPIRATORY DISEASES | PURDUE RESEARCH FOUNDATION (US) | 2010-02-25 | — | — | WO | disclosed |