Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.59 |
| ▸ | CA1 | P00915 | 1/20 | 0.59 |
| ▸ | CA2 | P00918 | 1/20 | 0.59 |
| ▸ | CA9 | Q16790 | 1/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.49 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.49 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL7428266 | 0.85 | CA12 (0.54) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL434636 | 0.82 | CA12 (0.56) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL7428282 | 0.81 | MAPT (0.60) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL11923036 | 0.81 | L3MBTL1 (0.73) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL3454327 | 0.80 | CA12 (0.62) | CA12CA1CA2CA9L3MBTL1 | |
| SCHEMBL10522559 | 0.79 | CA12 (0.53) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL2746235 | 0.79 | L3MBTL1 (0.54) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL10277409 | 0.79 | L3MBTL1 (0.61) | ALDH1A1L3MBTL1CYP1A2CYP2C9CYP2C19 | |
| Trifluoroacetic Acid SCHEMBL30725604 | 0.79 | KLK1 (0.51) | ALDH1A1L3MBTL1MAPTKMT2AMEN1 | |
| SCHEMBL22117072 | 0.78 | LMNA (0.57) | CA12CA1CA2CA9ALDH1A1 |
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-2023122212-A2 | SUBSTITUTED PHENYL ETHYNYL PYRIDINE CARBOXAMIDES AS POTENT INHIBITORS OF SARS VIRUS | SOUTHERN RESEARCH INSTITUTE (US) | 2023-06-29 | — | — | WO | disclosed |