Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 4/20 | 0.45 |
| ▸ | CA1 | P00915 | 4/20 | 0.45 |
| ▸ | CA2 | P00918 | 4/20 | 0.45 |
| ▸ | CA9 | Q16790 | 4/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 2/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MGLL | Q99685 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL21034810 | 0.95 | CA12 (0.48) | CA12CA1CA2CA9NPC1 | |
| SCHEMBL21679591 | 0.91 | CA12 (0.45) | CA12CA1CA2CA9MEN1 | |
| SCHEMBL21034803 | 0.86 | CA12 (0.41) | CA12CA1CA2CA9HTT | |
| SCHEMBL21679592 | 0.82 | CA12 (0.39) | CA12CA1CA2CA9MEN1 | |
| SCHEMBL13871217 | 0.82 | POLB (0.41) | CA12CA1CA2CA9MEN1 | |
| SCHEMBL4747310 | 0.80 | MAPT (0.40) | KDM4EMEN1ALDH1A1HTTKMT2A | |
| SCHEMBL13722220 | 0.80 | POLB (0.49) | CA12CA1CA2CA9MEN1 | |
| SCHEMBL21033752 | 0.80 | THRB (0.49) | CA12CA1CA2CA9MEN1 | |
| SCHEMBL13431250 | 0.80 | MAPT (0.41) | CA12CA1CA2CA9MEN1 | |
| SCHEMBL13431253 | 0.79 | MAPT (0.40) | CA12CA1CA2CA9KDM4E |
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-2019104079-A1 | ORTHODONTIC ARTICLES COMPRISING POLYMERIZED COMPOSITION COMPRISING AT LEAST TWO FREE-RADICAL INITIATORS | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2019-05-31 | — | — | WO | disclosed |