Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.47 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.47 |
| ▸ | HTR2A | P28223 | 1/20 | 0.47 |
| ▸ | SCN1A | P35498 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.47 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.47 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | USP2 | O75604 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | PRKAB2 | O43741 | 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 | |
|---|---|---|---|---|
| SCHEMBL13848378 | 0.89 | RAB9A (0.47) | KMT2AMEN1HRH3NPC1RAB9A | |
| SCHEMBL4059575 | 0.88 | NPC1 (0.48) | KMT2AMEN1NPC1RAB9APRKAB2 | |
| SCHEMBL13847844 | 0.88 | TLR9 (0.42) | KMT2AMEN1HRH3ALDH1A1MAPK1 | |
| SCHEMBL13848085 | 0.84 | HSP90AA1 (0.37) | KMT2AMEN1HRH3ALDH1A1MAPK1 | |
| SCHEMBL4245797 | 0.84 | MEN1 (0.50) | KMT2AMEN1HRH3ALDH1A1NPC1 | |
| SCHEMBL13848091 | 0.82 | IDO1 (0.39) | KMT2AMEN1CYP1A2NPC1RAB9A | |
| SCHEMBL13848454 | 0.82 | NPC1 (0.44) | KMT2AMEN1HRH3ALDH1A1NPC1 | |
| SCHEMBL13848385 | 0.81 | TSHR (0.44) | KMT2AMEN1HRH3NPC1RAB9A | |
| SCHEMBL13848084 | 0.81 | TSHR (0.46) | KMT2AMEN1HRH3NPC1RAB9A | |
| SCHEMBL13848452 | 0.80 | MAPK14 (0.37) | CYP1A2PTPN1ACHE |
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-2009066060-A2 | 4-SUBSTITUTED-6-ISOPROPYL-BENZENE-1,3-DIOL COMPOUNDS AND THEIR USE | TOPOTARGET A/S (DK) | 2009-05-28 | — | — | WO | disclosed |