Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MAPK9 | P45984 | 2/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | CMA1 | P23946 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | MIF | P14174 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30544472 | 0.79 | LPL (0.44) | CYP3A4ATMPOLBALDH1A1HSD17B10 | |
| SCHEMBL3148663 | 0.79 | LPL (0.44) | CYP3A4ATMPOLBALDH1A1HSD17B10 | |
| SCHEMBL5899518 | 0.73 | POLB (0.40) | CYP3A4TAAR1ATMPOLBALDH1A1 | |
| SCHEMBL15240051 | 0.70 | RXRA (0.36) | CYP3A4 | |
| SCHEMBL5899619 | 0.70 | CYP3A4 (0.39) | CYP3A4TAAR1ATMPOLBALDH1A1 | |
| SCHEMBL14212260 | 0.69 | LPL (0.44) | POLB | |
| SCHEMBL29634547 | 0.69 | LPL (0.44) | POLB | |
| SCHEMBL14746387 | 0.68 | ALDH1A1 (0.55) | POLBALDH1A1MAPK1MEN1KMT2A | |
| SCHEMBL15241249 | 0.68 | RXRA (0.34) | — | |
| SCHEMBL30495575 | 0.68 | TAAR1 (0.54) | CYP3A4TAAR1SLC6A4SLC6A3SLC6A2 |
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-3611174-A1 | [1,2,4]TRIAZOLO[1,5-C]PYRIMIDINE DERIVATIVE AS A2A RECEPTOR INHIBITOR | Medshine Discovery Inc. (CN) | 2020-02-19 | — | — | EP | disclosed |