Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 12/20 | 0.52 |
| ▸ | CA12 | O43570 | 11/20 | 0.52 |
| ▸ | CA1 | P00915 | 9/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.52 |
| ▸ | GLA | P06280 | 5/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.52 |
| ▸ | MCL1 | Q07820 | 4/20 | 0.52 |
| ▸ | GAA | P10253 | 4/20 | 0.52 |
| ▸ | AKR1B1 | P15121 | 3/20 | 0.52 |
| ▸ | HPGD | P15428 | 3/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.52 |
| ▸ | CASP1 | P29466 | 2/20 | 0.52 |
| ▸ | CASP7 | P55210 | 2/20 | 0.52 |
| ▸ | ERAP1 | Q9NZ08 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | CA6 | P23280 | 5/20 | 0.51 |
| ▸ | CA7 | P43166 | 5/20 | 0.51 |
| ▸ | CA14 | Q9ULX7 | 5/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL5048040 | 0.82 | CA12 (0.49) | CA9CA12CA1KDM4EGLA | |
| SCHEMBL5045519 | 0.79 | PGR (0.45) | CA9CA12CA1KDM4EGLA | |
| SCHEMBL3368470 | 0.76 | KDM4E (0.51) | CA9CA12CA1KDM4EGLA | |
| SCHEMBL30417141 | 0.72 | PGR (0.59) | CA9CA12CA1KDM4EGLA | |
| SCHEMBL646703 | 0.72 | PGR (0.59) | CA9CA12CA1KDM4EGLA | |
| SCHEMBL6542961 | 0.71 | CA12 (0.72) | CA9CA12CA1KDM4EGLA | |
| SCHEMBL3521157 | 0.70 | DRD4 (0.52) | CA9CA12CA1KDM4EGLA | |
| SCHEMBL5539713 | 0.70 | CA12 (0.61) | CA9CA12CA1KDM4EGLA | |
| SCHEMBL11033273 | 0.68 | CA12 (0.59) | CA9CA12CA1KDM4EGLA | |
| SCHEMBL456597 | 0.68 | CA12 (0.59) | CA9CA12CA1KDM4EGLA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1481973-B1 | HETEROCYCLE-BEARING ONIUM SALTS | WAKO PURE CHEM IND LTD (JP) | 2008-12-31 | — | — | EP | disclosed |
| EP-1481973-A1 | HETEROCYCLE-BEARING ONIUM SALTS | Wako Pure Chemical Industries, Ltd. (JP) | 2004-12-01 | — | — | EP | disclosed |