Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 5/20 | 0.35 |
| ▸ | CA9 | Q16790 | 5/20 | 0.35 |
| ▸ | CA1 | P00915 | 4/20 | 0.35 |
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | STS | P08842 | 1/20 | 0.35 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | KIF11 | P52732 | 1/20 | 0.32 |
| ▸ | PIM1 | P11309 | 1/20 | 0.31 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.30 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.30 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.30 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.30 |
| ▸ | TOP2A | P11388 | 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 | |
|---|---|---|---|---|
| SCHEMBL7865332 | 0.82 | TDP1 (0.38) | TDP1ALDH1A1CA2CA9CA1 | |
| SCHEMBL8108082 | 0.73 | ALDH1A1 (0.46) | TDP1ALDH1A1PIM1PIM2CHRNB2 | |
| SCHEMBL171790 | 0.73 | ALDH1A1 (0.50) | ALDH1A1KIF11PIM1PIM2CHRNB2 | |
| SCHEMBL17409277 | 0.72 | STS (0.40) | TDP1ALDH1A1CA2CA9CA1 | |
| SCHEMBL677360 | 0.71 | TDP1 (0.44) | TDP1ALDH1A1CA2CA9CA1 | |
| SCHEMBL28994316 | 0.70 | CA1 (0.58) | TDP1ALDH1A1CA2CA9CA1 | |
| SCHEMBL943450 | 0.70 | TDP1 (0.42) | TDP1ALDH1A1CA2CA9CA1 | |
| SCHEMBL7865327 | 0.70 | TDP1 (0.43) | TDP1ALDH1A1CA2CA9CA1 | |
| Lithium Ion SCHEMBL6850337 | 0.70 | TDP1 (0.40) | TDP1ALDH1A1CA2CA9CA1 | |
| Hydrogen Sulfide SCHEMBL29027315 | 0.69 | TDP1 (0.41) | TDP1ALDH1A1CA2CA9CA1 |
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-1095071-A1 | AROMATIC POLYMERS WITH PENDANT FLUORINATED IONIC GROUPS | E.I. DUPONT DE NEMOURS AND COMPANY (US) | 2001-05-02 | — | — | EP | disclosed |
| WO-1999067304-A1 | AROMATIC POLYMERS WITH PENDANT FLUORINATED IONIC GROUPS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1999-12-29 | — | — | WO | disclosed |