Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 4/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.41 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.41 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18422847 | 0.83 | TACR1 (0.51) | TACR1SIGMAR1SLC18A3TMEM97OPRD1 | |
| SCHEMBL15652887 | 0.80 | TACR1 (0.51) | TACR1SIGMAR1SLC18A3TMEM97TSHR | |
| SCHEMBL6873760 | 0.72 | MEN1 (0.43) | TACR1SIGMAR1SLC18A3TMEM97TSHR | |
| SCHEMBL6873757 | 0.72 | MEN1 (0.43) | TACR1SIGMAR1SLC18A3TMEM97TSHR | |
| SCHEMBL6883069 | 0.72 | MEN1 (0.43) | TACR1SIGMAR1SLC18A3TMEM97TSHR | |
| SCHEMBL8073204 | 0.72 | TACR1 (0.46) | TACR1SIGMAR1SLC18A3TMEM97TSHR | |
| SCHEMBL24812385 | 0.71 | KDM1A (0.58) | KDM1AMAOAMAOB | |
| SCHEMBL24812728 | 0.71 | KDM1A (0.58) | KDM1AMAOAMAOB | |
| SCHEMBL24811346 | 0.71 | KDM1A (0.58) | KDM1AMAOAMAOB | |
| SCHEMBL24811345 | 0.71 | KDM1A (0.58) | KDM1AMAOAMAOB |
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-2018026371-A1 | DUAL NAV1.2/5HT2A INHIBITORS FOR TREATING CNS DISORDERS | SUNOVION PHARMACEUTICALS INC. (US) | 2018-02-08 | — | — | WO | disclosed |