Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.54 |
| ▸ | HRH3 | Q9Y5N1 | 11/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.52 |
| ▸ | HTR2A | P28223 | 1/20 | 0.52 |
| ▸ | SCN1A | P35498 | 1/20 | 0.52 |
| ▸ | HTR2B | P41595 | 1/20 | 0.52 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.52 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.52 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL10626 | 0.81 | HRH3 (0.63) | HRH3MAPK1ALDH1A1CYP1A2CHRM2 | |
| SCHEMBL15522497 | 0.78 | EPHX2 (0.60) | HRH3MAPK1ALDH1A1CYP1A2CHRM2 | |
| SCHEMBL15522535 | 0.78 | EPHX2 (0.66) | HRH3MAPK1ALDH1A1CYP1A2CHRM2 | |
| SCHEMBL23963137 | 0.77 | HRH3 (0.67) | KMT2AHRH3MAPK1ALDH1A1CYP1A2 | |
| SCHEMBL15581514 | 0.77 | EPHX2 (0.64) | HRH3MAPK1ALDH1A1CYP1A2CHRM2 | |
| SCHEMBL10377 | 0.76 | NPC1 (0.58) | NPC1RAB9AKMT2AHRH3ALDH1A1 | |
| SCHEMBL29973108 | 0.76 | HRH3 (0.69) | KMT2AHRH3MAPK1ALDH1A1CYP1A2 | |
| SCHEMBL10625 | 0.76 | HRH3 (0.61) | MEN1NPC1RAB9AKMT2AHRH3 | |
| SCHEMBL874183 | 0.75 | LTA4H (0.61) | NPC1RAB9AKMT2AHRH3MAPK1 | |
| SCHEMBL23291288 | 0.75 | EPHX2 (0.60) | HRH3MAPK1ALDH1A1CYP1A2CHRM2 |
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-2014041424-A1 | HISTONE DEACETYLASE INHIBITORS FOR ENHANCING ACTIVITY OF ANTIFUNGAL AGENTS | METHYLGENE INC. (CA) | 2014-03-20 | — | — | WO | disclosed |