Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 3/20 | 0.32 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.31 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.31 |
| ▸ | SLC6A1 | P30531 | 2/20 | 0.30 |
| ▸ | SLC6A11 | P48066 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | SLC6A13 | Q9NSD5 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL28120081 | 0.93 | PKM (0.32) | PKMKDM1AHRH4HRH3 | |
| Trifluoroacetic Acid SCHEMBL15355467 | 0.85 | TSHR (0.37) | PKMKDM1AHRH4HRH3SLC6A1 | |
| Trifluoroacetic Acid SCHEMBL28845085 | 0.84 | TSHR (0.32) | PKMKDM1ASLC6A1TSHRLMNA | |
| Trifluoroacetic Acid SCHEMBL30746009 | 0.84 | TSHR (0.32) | PKMKDM1ASLC6A1TSHRLMNA | |
| Trifluoroacetic Acid SCHEMBL30745983 | 0.84 | TSHR (0.32) | PKMKDM1ASLC6A1TSHRLMNA | |
| Trifluoroacetic Acid SCHEMBL28258973 | 0.80 | ALDH1A1 (0.35) | PKMKDM1AHRH4HRH3SLC6A1 | |
| Trifluoroacetic Acid SCHEMBL6826527 | 0.80 | ALDH1A1 (0.42) | PKMKDM1AHRH4HRH3SLC6A1 | |
| Trifluoroacetic Acid SCHEMBL2721516 | 0.80 | ALDH1A1 (0.42) | PKMKDM1AHRH4HRH3SLC6A1 | |
| Trifluoroacetic Acid SCHEMBL31550881 | 0.79 | PKM (0.36) | PKMKDM1AHRH4HRH3SLC6A1 | |
| Trifluoroacetic Acid SCHEMBL15513076 | 0.78 | ALDH1A1 (0.47) | PKMKDM1AHRH4HRH3SLC6A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106458985-B | 6-heteroaryloxy-and 6-aryloxy-quinoline-2-carboxamides and their use | 艾伯维公司 | 2019-05-03 | — | — | CN | disclosed |