Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.58 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.58 |
| ▸ | MAOB | P27338 | 8/20 | 0.57 |
| ▸ | MAOA | P21397 | 7/20 | 0.57 |
| ▸ | NPC1 | O15118 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 3/20 | 0.49 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL16892218 | 0.90 | SPHK2 (0.61) | SPHK2SPHK1MAOBMAOANPC1 | |
| SCHEMBL16892157 | 0.82 | SPHK2 (0.49) | SPHK2SPHK1SCN3A | |
| SCHEMBL16892177 | 0.82 | MAOB (0.60) | MAOBMAOANPC1RAB9A | |
| SCHEMBL16892175 | 0.82 | MAOB (0.60) | MAOBMAOANPC1RAB9A | |
| SCHEMBL8843511 | 0.80 | DPP7 (0.59) | NPC1RAB9AALDH1A1LMNATSHR | |
| SCHEMBL16892226 | 0.80 | ALDH1A1 (0.52) | SPHK2SPHK1SCN3AALDH1A1MAPK1 | |
| SCHEMBL16892155 | 0.80 | MAOB (0.52) | MAOBMAOANPC1RAB9A | |
| SCHEMBL16892201 | 0.80 | MAOB (0.52) | MAOBMAOANPC1RAB9A | |
| Hydrochloric Acid SCHEMBL5009249 | 0.76 | HEXA (0.52) | MAOBMAOANPC1RAB9AALDH1A1 | |
| SCHEMBL964037 | 0.75 | SPHK2 (0.67) | SPHK2SPHK1MAOBMAOANPC1 |
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-2015101294-A1 | COMPOUNDS WITH ANALGESIC ACTIVITY AND MEDICAL USE THEREOF | 中国人民解放军军事医学科学院毒物药物研究所 | 2015-07-09 | — | — | WO | disclosed |