Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.50 |
| ▸ | PPARG | P37231 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | KMO | O15229 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | MMP8 | P22894 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | MME | P08473 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4226578 | 1.00 | NPC1 (0.60) | NPC1KMT2AMEN1EPHX2PPARG | |
| SCHEMBL1748086 | 0.88 | NPC1 (0.58) | NPC1KMT2AMEN1EPHX2PPARG | |
| SCHEMBL6031378 | 0.88 | NPC1 (0.58) | NPC1KMT2AMEN1EPHX2PPARG | |
| SCHEMBL4235715 | 0.84 | NPC1 (0.55) | NPC1KMT2AMEN1EPHX2PPARG | |
| SCHEMBL5067922 | 0.84 | NPC1 (0.55) | NPC1KMT2AMEN1EPHX2PPARG | |
| SCHEMBL4222917 | 0.84 | KMT2A (0.65) | NPC1KMT2AMEN1EPHX2PPARG | |
| SCHEMBL4227535 | 0.82 | KMT2A (0.51) | NPC1KMT2AMEN1EPHX2PPARG | |
| SCHEMBL1748271 | 0.82 | NPC1 (0.55) | NPC1KMT2AMEN1RAB9ALMNA | |
| SCHEMBL14571476 | 0.80 | KMT2A (0.68) | NPC1KMT2AMEN1RAB9ALMNA | |
| SCHEMBL7530142 | 0.79 | KMT2A (0.75) | NPC1KMT2AMEN1RAB9ALMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1874317-A2 | PREPARATION AND USE OF ARYL ALKYL ACID DERIVATIVES FOR THE TREATMENT OF OBESITY | Bayer Pharmaceuticals Corporation (US) | 2008-01-09 | — | — | EP | disclosed |
| WO-2006113919-A2 | ARYL ALKYL ACID DERIVATIVES FOR AND USE THEREOF | BAYER PHARMACEUTICALS CORPORATION (US) | 2006-10-26 | — | — | WO | disclosed |