Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | PDIA6 | Q15084 | 1/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10801499 | 0.83 | CA12 (0.50) | NPC1MAPTRAB9APDIA6ALDH1A1 | |
| SCHEMBL3146478 | 0.82 | DRD2 (0.51) | NPC1MAPTSMN1; SMN2RAB9APDIA6 | |
| SCHEMBL25261232 | 0.79 | SMN1; SMN2 (0.49) | NPC1MAPTSMN1; SMN2RAB9APDIA6 | |
| SCHEMBL26023458 | 0.79 | NPC1 (0.48) | NPC1MAPTSMN1; SMN2RAB9APDIA6 | |
| SCHEMBL13518443 | 0.79 | NCF1 (0.51) | NPC1MAPTSMN1; SMN2RAB9APDIA6 | |
| SCHEMBL4608319 | 0.78 | PDIA6 (0.44) | NPC1MAPTSMN1; SMN2RAB9APDIA6 | |
| SCHEMBL8146789 | 0.78 | NPC1 (0.66) | NPC1MAPTSMN1; SMN2RAB9AAPP | |
| SCHEMBL25365174 | 0.76 | PDIA6 (0.58) | NPC1MAPTSMN1; SMN2RAB9APDIA6 | |
| SCHEMBL13518778 | 0.76 | PDIA6 (0.50) | NPC1RAB9APDIA6 | |
| SCHEMBL13518558 | 0.76 | PDIA6 (0.43) | SMN1; SMN2PDIA6MCL1KDM4ETDP1 |
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-1945620-A2 | COMPOUNDS AND COMPOSITIONS AS PPAR MODULATORS | IRM LLC (BM) | 2008-07-23 | — | — | EP | disclosed |
| WO-2007056366-A2 | COMPOUNDS AND COMPOSITIONS AS PPAR MODULATORS | IRM LLC (BM) | 2007-05-18 | — | — | WO | disclosed |