Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | AR | P10275 | 5/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | PGR | P06401 | 2/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | CRHBP | P24387 | 1/20 | 0.43 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.43 |
| ▸ | CPA1 | P15085 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4235715 | 1.00 | NPC1 (0.55) | NPC1MEN1KMT2ATP53RAB9A | |
| SCHEMBL1747949 | 0.89 | NPC1 (0.53) | NPC1MEN1KMT2ATP53RAB9A | |
| SCHEMBL6031308 | 0.89 | NPC1 (0.53) | NPC1MEN1KMT2ATP53RAB9A | |
| SCHEMBL4235377 | 0.86 | NPC1 (0.46) | NPC1MEN1KMT2ATP53RAB9A | |
| SCHEMBL1747989 | 0.84 | MEN1 (0.50) | NPC1MEN1KMT2ARAB9ASMN1; SMN2 | |
| SCHEMBL4226578 | 0.84 | NPC1 (0.60) | NPC1MEN1KMT2ARAB9ASMN1; SMN2 | |
| SCHEMBL5068844 | 0.84 | NPC1 (0.60) | NPC1MEN1KMT2ARAB9ASMN1; SMN2 | |
| SCHEMBL1748000 | 0.81 | MEN1 (0.47) | NPC1MEN1KMT2ARAB9ASMN1; SMN2 | |
| SCHEMBL6031201 | 0.81 | MEN1 (0.47) | NPC1MEN1KMT2ARAB9ASMN1; SMN2 | |
| SCHEMBL4233738 | 0.81 | MAPT (0.54) | NPC1MEN1KMT2ARAB9ASMN1; SMN2 |
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 |