Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 2/20 | 0.47 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 9/20 | 0.41 |
| ▸ | HTR2C | P28335 | 9/20 | 0.41 |
| ▸ | HTR2B | P41595 | 9/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | MGLL | Q99685 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL19996264 | 1.00 | ALOX5 (0.47) | ALOX5OPRM1HTR2AHTR2CHTR2B | |
| SCHEMBL25144854 | 0.81 | ADRB1 (0.50) | ALOX5OPRM1HTR2AHTR2CHTR2B | |
| SCHEMBL25144905 | 0.81 | ADRB1 (0.50) | ALOX5OPRM1HTR2AHTR2CHTR2B | |
| SCHEMBL25144858 | 0.79 | HTR2A (0.50) | ALOX5OPRM1HTR2AHTR2CHTR2B | |
| SCHEMBL23777634 | 0.79 | HTR2A (0.50) | ALOX5OPRM1HTR2AHTR2CHTR2B | |
| SCHEMBL2463430 | 0.79 | OPRM1 (0.66) | OPRM1HTR2AHTR2CHTR2BMEN1 | |
| Hydrochloric Acid SCHEMBL18043593 | 0.79 | ADRB1 (0.49) | ALOX5OPRM1HTR2AHTR2CHTR2B | |
| SCHEMBL29327284 | 0.79 | HTR2C (0.50) | ALOX5OPRM1HTR2AHTR2CHTR2B | |
| SCHEMBL21876550 | 0.78 | HTR2A (0.43) | HTR2AHTR2CHTR2B | |
| SCHEMBL30179232 | 0.78 | HTR2A (0.43) | HTR2AHTR2CHTR2B |
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-3209664-A1 | BICYCLIC HETEROARYL AMINE COMPOUNDS AS PI3K INHIBITORS | Bristol-Myers Squibb Company (US) | 2017-08-30 | — | — | EP | disclosed |