Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | PKM | P14618 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.39 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.33 |
| ▸ | EGFR | P00533 | 2/20 | 0.32 |
| ▸ | SCN8A | Q9UQD0 | 1/20 | 0.32 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.32 |
| ▸ | CTSS | P25774 | 1/20 | 0.32 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7595676 | 0.86 | ALDH1A1 (0.49) | ALDH1A1KMT2AKDM4EGAAMAPK1 | |
| SCHEMBL7591337 | 0.84 | ALDH1A1 (0.47) | ALDH1A1KDM4EMAPK1HSD17B10TSHR | |
| SCHEMBL7590153 | 0.82 | TSHR (0.50) | ALDH1A1MAPK1HSD17B10TSHRL3MBTL1 | |
| SCHEMBL7593446 | 0.81 | TSHR (0.44) | ALDH1A1KDM4ETSHRL3MBTL1TDP1 | |
| SCHEMBL7595389 | 0.81 | TSHR (0.51) | ALDH1A1KDM4EMAPK1HSD17B10TSHR | |
| SCHEMBL7597693 | 0.78 | CA12 (0.41) | ALDH1A1PKMKDM4EHSD17B10 | |
| SCHEMBL7590145 | 0.77 | L3MBTL1 (0.39) | ALDH1A1PKMGABRA1GABRA3L3MBTL1 | |
| SCHEMBL7595315 | 0.77 | ALDH1A1 (0.39) | ALDH1A1L3MBTL1CTSS | |
| SCHEMBL7595297 | 0.76 | CFTR (0.50) | KDM4E | |
| SCHEMBL20695629 | 0.75 | ALDH1A1 (0.56) | ALDH1A1PKMKMT2AKDM4EGAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-0968994-B1 | PROCESS FOR PRODUCING SUBSTITUTED TRIFLUOROBENZOIC ACIDS AND ESTERS THEREOF | UBE INDUSTRIES (JP) | 2002-11-06 | — | — | EP | claimed |