Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 5/20 | 0.52 |
| ▸ | CA2 | P00918 | 5/20 | 0.52 |
| ▸ | CA7 | P43166 | 3/20 | 0.52 |
| ▸ | CA9 | Q16790 | 3/20 | 0.52 |
| ▸ | CA12 | O43570 | 2/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.43 |
| ▸ | CES1 | P23141 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | CA4 | P22748 | 1/20 | 0.42 |
| ▸ | CA5A | P35218 | 1/20 | 0.42 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.42 |
| ▸ | PLK1 | P53350 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29178594 | 0.84 | TDP1 (0.56) | CA1CA2CA7CA9CA12 | |
| SCHEMBL4734193 | 0.80 | CA12 (0.39) | CA1CA2CA7CA9CA12 | |
| SCHEMBL14339303 | 0.80 | CA1 (0.58) | CA1CA2CA7CA9CA12 | |
| SCHEMBL1001220 | 0.80 | CA1 (0.58) | CA1CA2CA7CA9CA12 | |
| SCHEMBL1306136 | 0.79 | MMP9 (0.46) | CA1CA2CA7CA9CA12 | |
| SCHEMBL10722266 | 0.79 | LTA4H (0.54) | CA1CA2CA7CA9CA12 | |
| SCHEMBL10588496 | 0.78 | CA1 (0.55) | CA1CA2CA7CA9CA12 | |
| SCHEMBL384926 | 0.78 | HPGD (0.54) | CA1CA2CA7CA9CA12 | |
| SCHEMBL18417836 | 0.78 | CA1 (0.55) | CA1CA2CA7CA9CA12 | |
| SCHEMBL18417833 | 0.77 | CA1 (0.48) | CA1CA2CA7CA9CA12 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20170033304-A1 | PHOTOVOLTAIC ELEMENT | TORAY INDUSTRIES, INC. (JP) | 2017-02-02 | — | — | US | disclosed |
| EP-0127876-B1 | PROCESS FOR PREPARING PHOSPHONIC-ACID ESTERS, AND PHOSPHONIC ACID DERIVATIVES | HOECHST AKTIENGESELLSCHAFT (DE) | 1987-08-12 | — | — | EP | disclosed |
| US-4655883-A | ANODIZING AN AROMATIC COMPOUND IN THE PRESENCE OF A PHOSPHITE AND ALKANOL IN A ELECTROLYTIC CELL | HOECHST AKTIENGESELLSCHAFT (DE) | 1987-04-07 | — | — | US | disclosed |
| EP-0127876-A2 | Process for preparing phosphonic-acid esters, and phosphonic acid derivatives | HOECHST AKTIENGESELLSCHAFT (DE) | 1984-12-12 | — | — | EP | disclosed |