Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 5/20 | 0.55 |
| ▸ | RARG | P13631 | 5/20 | 0.55 |
| ▸ | RARA | P10276 | 5/20 | 0.50 |
| ▸ | CYP26A1 | O43174 | 4/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.47 |
| ▸ | RORA | P35398 | 1/20 | 0.46 |
| ▸ | RORC | P51449 | 1/20 | 0.46 |
| ▸ | PLAU | P00749 | 1/20 | 0.46 |
| ▸ | CYP26B1 | Q9NR63 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL9379480 | 0.88 | BACE1 (0.52) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL9376603 | 0.88 | BACE1 (0.52) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL9379462 | 0.86 | RAB9A (0.53) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL9376618 | 0.85 | RARB (0.56) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL9375662 | 0.84 | MAPT (0.56) | KMT2AMEN1MAPTRAB9APOLB | |
| SCHEMBL23143565 | 0.82 | TRPV1 (0.56) | PTPN1RORARORCPLAUHDAC3 | |
| SCHEMBL9314264 | 0.81 | MEN1 (0.53) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL9312256 | 0.81 | RARB (0.51) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL9139650 | 0.81 | RARB (0.73) | RARBRARGRARACYP26A1CYP3A4 | |
| SCHEMBL9312277 | 0.81 | KMT2A (0.49) | RARBRARGRARACYP26A1CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0344634-B1 | Bicyclic carboxamides, process for their preparation and medicaments containing them | BOEHRINGER MANNHEIM GMBH (DE) | 1994-03-30 | — | — | EP | disclosed |
| US-5019587-A | Anticoagulants | BOEHRINGER MANNHEIM GMBH (DE) | 1991-05-28 | — | — | US | disclosed |
| WO-1991001986-A1 | N-(DIALKYLOXOPHOSPHINYLALKYL)-LACTAMS, PROCESS FOR PREPARING THEM AND DRUGS CONTAINING THEM | BOEHRINGER MANNHEIM GMBH (DE) | 1991-02-21 | — | — | WO | disclosed |