Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHAT | P28329 | 2/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | RAB9A | P51151 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.39 |
| ▸ | RELA | Q04206 | 1/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11791997 | 1.00 | CHAT (0.64) | CHATKMT2ANPC1RAB9AALDH1A1 | |
| SCHEMBL11792658 | 0.78 | KMT2A (0.80) | CHATKMT2ANPC1RAB9AALDH1A1 | |
| SCHEMBL11792652 | 0.78 | KMT2A (0.80) | CHATKMT2ANPC1RAB9AALDH1A1 | |
| Hydrochloric Acid SCHEMBL11789363 | 0.76 | KMT2A (0.83) | CHATKMT2ANPC1RAB9AALDH1A1 | |
| Hydrochloric Acid SCHEMBL11789369 | 0.76 | KMT2A (0.83) | CHATKMT2ANPC1RAB9AALDH1A1 | |
| SCHEMBL11468144 | 0.76 | ADRA2A (0.46) | CHATALDH1A1MAPTL3MBTL1ADRA2A | |
| SCHEMBL11468146 | 0.76 | ADRA2A (0.46) | CHATALDH1A1MAPTL3MBTL1ADRA2A | |
| SCHEMBL11799125 | 0.76 | HRH4 (0.42) | CHATKMT2AALDH1A1HRH4MAPT | |
| SCHEMBL10261031 | 0.75 | KMT2A (0.67) | CHATKMT2ANPC1RAB9AALDH1A1 | |
| SCHEMBL1058814 | 0.70 | ALDH1A1 (0.62) | CHATKMT2ANPC1RAB9AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-3965102-A | ANTIINFLAMMATORY | E. R. SQUIBB & SONS, INC. (US) | 1976-06-22 | — | — | US | disclosed |