Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | RET | P07949 | 1/20 | 0.41 |
| ▸ | KIF5B | P33176 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | GRM5 | P41594 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6452765 | 0.72 | SCN9A (0.46) | TSHRSCN9AHPGDL3MBTL1KDM4E | |
| SCHEMBL29397819 | 0.68 | TSHR (0.43) | TSHRSCN9AHPGDRAB9AKDM4E | |
| SCHEMBL24337345 | 0.68 | L3MBTL1 (0.42) | POLBTSHRSCN9AHPGDL3MBTL1 | |
| SCHEMBL2814888 | 0.67 | SCN9A (0.54) | TSHRSCN9ARAB9AKDM4EALDH1A1 | |
| SCHEMBL20090371 | 0.67 | HTR2A (0.44) | POLBTSHRSCN9AHPGDL3MBTL1 | |
| SCHEMBL2814439 | 0.67 | SCN9A (0.54) | TSHRSCN9ARAB9AKDM4EALDH1A1 | |
| SCHEMBL12697009 | 0.67 | ALDH1A1 (0.49) | POLBTSHRSCN9ARAB9AKDM4E | |
| SCHEMBL12697089 | 0.67 | ALDH1A1 (0.49) | POLBTSHRSCN9ARAB9AKDM4E | |
| SCHEMBL21566951 | 0.66 | HTR2A (0.43) | POLBTSHRSCN9AL3MBTL1RAB9A | |
| SCHEMBL30151904 | 0.66 | SCN9A (0.53) | TSHRSCN9ARAB9AKDM4EALDH1A1 |
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-1567498-A2 | MANDELIC ACID DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2005-08-31 | — | — | EP | disclosed |
| WO-2004048335-A2 | MANDELIC ACID DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2004-06-10 | — | — | WO | disclosed |