Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.59 |
| ▸ | TP53 | P04637 | 6/20 | 0.59 |
| ▸ | RAB9A | P51151 | 6/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.59 |
| ▸ | NPC1 | O15118 | 6/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.59 |
| ▸ | TSHR | P16473 | 6/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | HPGD | P15428 | 2/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.51 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL493675 | 0.81 | ALDH1A1 (0.64) | ALDH1A1TP53RAB9ASMN1; SMN2NPC1 | |
| SCHEMBL3661963 | 0.78 | MAPT (0.59) | ALDH1A1TP53RAB9ASMN1; SMN2NPC1 | |
| SCHEMBL4083201 | 0.77 | NR1H4 (0.52) | ALDH1A1TP53RAB9ASMN1; SMN2NPC1 | |
| SCHEMBL6328368 | 0.75 | ALDH1A1 (0.67) | ALDH1A1TP53RAB9ASMN1; SMN2NPC1 | |
| SCHEMBL1250902 | 0.74 | SMN1; SMN2 (0.67) | ALDH1A1TP53RAB9ASMN1; SMN2NPC1 | |
| SCHEMBL6979588 | 0.74 | RAB9A (0.61) | ALDH1A1TP53RAB9ASMN1; SMN2NPC1 | |
| SCHEMBL8765509 | 0.73 | ALDH1A1 (0.53) | ALDH1A1SMN1; SMN2KMT2AHTTHSD17B10 | |
| SCHEMBL493192 | 0.73 | NPC1 (0.56) | ALDH1A1TP53RAB9ASMN1; SMN2NPC1 | |
| SCHEMBL23288078 | 0.72 | CASP3 (0.71) | ALDH1A1TP53RAB9ASMN1; SMN2NPC1 | |
| SCHEMBL3046287 | 0.72 | L3MBTL1 (0.62) | ALDH1A1TP53RAB9ASMN1; SMN2NPC1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2139851-A2 | SUBSTITUTED AMIDE DERIVATIVES | Grünenthal GmbH (DE) | 2010-01-06 | — | — | EP | claimed |
| WO-2008131946-A2 | SUBSTITUTED AMIDE DERIVATIVES | Grünenthal GmbH (DE) | 2008-11-06 | — | — | WO | claimed |
| EP-2139851-A2 | SUBSTITUTED AMIDE DERIVATIVES | Grünenthal GmbH (DE) | 2010-01-06 | — | — | EP | disclosed |
| WO-2008131946-A2 | SUBSTITUTED AMIDE DERIVATIVES | Grünenthal GmbH (DE) | 2008-11-06 | — | — | WO | disclosed |