Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 2/20 | 0.53 |
| ▸ | MTOR | P42345 | 1/20 | 0.47 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | SRC | P12931 | 1/20 | 0.41 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL16684532 | 0.82 | TRPM8 (0.55) | ALOX5MTORTRPM8LMNAALDH1A1 | |
| SCHEMBL4465930 | 0.78 | ALOX5 (0.57) | ALOX5MTORTRPM8CYP2D6SRC | |
| Benzene SCHEMBL28986126 | 0.77 | MTOR (0.62) | ALOX5MTORTRPM8CYP2D6SRC | |
| SCHEMBL117598 | 0.77 | ALOX5 (0.71) | ALOX5MTOR | |
| SCHEMBL6392152 | 0.77 | SRC (0.43) | ALOX5CYP2D6SRCLMNAMAPK1 | |
| SCHEMBL1520362 | 0.77 | MTOR (0.62) | ALOX5MTORTRPM8CYP2D6SRC | |
| SCHEMBL28280044 | 0.75 | ALOX5 (0.53) | ALOX5MTORTRPM8CYP2D6SRC | |
| SCHEMBL115981 | 0.75 | ALOX5 (0.58) | ALOX5MTORTRPM8CYP2D6SRC | |
| SCHEMBL15655256 | 0.75 | ALOX5 (0.49) | ALOX5MTORTRPM8LMNAKDM4E | |
| SCHEMBL15655258 | 0.75 | ALOX5 (0.49) | ALOX5MTORTRPM8LMNAKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-102014635-B | Difluoro-containing compounds as cysteine protease inhibitors | VIROBAY, INC. (US) | 2015-12-16 | — | — | CN | disclosed |
| CN-102057015-B | Chlorinated naphthalenetetracarboxylic acid derivatives, preparation thereof and use thereof in organic electronics | BASF SE | 2015-07-22 | — | — | CN | disclosed |