Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 2/20 | 0.35 |
| ▸ | ZDHHC20 | Q5W0Z9 | 2/20 | 0.33 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.33 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.33 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.33 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
| ▸ | PRCP | P42785 | 1/20 | 0.32 |
| ▸ | ADH1C | P00326 | 1/20 | 0.32 |
| ▸ | ADH1A | P07327 | 1/20 | 0.32 |
| ▸ | ADH4 | P08319 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 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 | |
|---|---|---|---|---|
| SCHEMBL28291781 | 1.00 | CA12 (0.35) | CA12CA1CA9CA2BCHE | |
| Hydrochloric Acid SCHEMBL28290340 | 0.98 | GNAI3 (0.35) | CA12CA1CA9CA2BCHE | |
| Hydrochloric Acid SCHEMBL28629335 | 0.98 | GNAI3 (0.35) | CA12CA1CA9CA2BCHE | |
| Hydrochloric Acid SCHEMBL28290328 | 0.98 | GNAI3 (0.35) | CA12CA1CA9CA2BCHE | |
| SCHEMBL28290337 | 0.94 | CA12 (0.38) | CA12CA1CA9BCHESIGMAR1 | |
| Hydrochloric Acid SCHEMBL28290322 | 0.92 | CA12 (0.37) | CA12CA1CA9BCHEGNAI3 | |
| SCHEMBL28969039 | 0.79 | BCHE (0.39) | CA12CA1CA9CA2BCHE | |
| SCHEMBL28291760 | 0.74 | GNAI3 (0.54) | GNAI3GNAO1GNAI1EPHX1PRCP | |
| SCHEMBL28291753 | 0.74 | GNAI3 (0.54) | GNAI3GNAO1GNAI1EPHX1PRCP | |
| SCHEMBL28291769 | 0.74 | GNAI3 (0.54) | GNAI3GNAO1GNAI1EPHX1PRCP |
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 |
|---|---|---|---|---|---|---|---|
| CN-109641878-A | DIPROVOCIM: a new class of effective TLR agonist | 斯克里普斯研究学院 | 2019-04-16 | — | — | CN | disclosed |