Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 6/20 | 0.40 |
| ▸ | CA2 | P00918 | 5/20 | 0.40 |
| ▸ | CA9 | Q16790 | 5/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 7/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | FDPS | P14324 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 1/20 | 0.32 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.31 |
| ▸ | CTSD | P07339 | 1/20 | 0.31 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4727561 | 0.87 | CA2 (0.36) | CA12CA2CA9TSHRMAPK1 | |
| SCHEMBL7468494 | 0.85 | CA2 (0.34) | CA12CA2CA9TSHRMAPK1 | |
| SCHEMBL20285412 | 0.83 | CA1 (0.44) | CA12CA2CA9TSHRCA1 | |
| SCHEMBL13760606 | 0.83 | CA2 (0.33) | CA12CA2CA9TSHRMAPK1 | |
| SCHEMBL27342440 | 0.83 | CA2 (0.33) | CA12CA2CA9TSHRMAPK1 | |
| SCHEMBL29634978 | 0.79 | ALDH1A1 (0.50) | CA2CA1ALDH1A1HPGDTP53 | |
| SCHEMBL27534700 | 0.79 | TDP1 (0.39) | CA12CA2CA9 | |
| SCHEMBL27619106 | 0.79 | ZDHHC20 (0.38) | CA12CA2CA9TSHRALDH1A1 | |
| SCHEMBL107452 | 0.77 | CA12 (0.52) | CA12CA2CA9TSHRMAPK1 | |
| SCHEMBL42388 | 0.77 | CA12 (0.52) | CA12CA2CA9TSHRMAPK1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117082975-A | Agrochemical composition | 诺力昂化学品国际有限公司 | 2023-11-17 | — | — | CN | disclosed |
| WO-2013089212-A1 | SUBSTITUTED TRIAZINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION CONTAINING SAME | 塩野義製薬株式会社 (JP) | 2013-06-20 | — | — | WO | disclosed |
| US-4111904-A | STABILIZATION OF POLYPYRROLIDONE | STAMICARBON, B.V. (NL) | 1978-09-05 | — | — | US | disclosed |