Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | NR1D1 | P20393 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | MGLL | Q99685 | 1/20 | 0.37 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.36 |
| ▸ | ITGB7 | P26010 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL396136 | 0.77 | ALDH1A1 (0.49) | ALDH1A1POLBMAPTLMNANPC1 | |
| SCHEMBL12520482 | 0.76 | ALDH1A1 (0.45) | ALDH1A1POLBMAPTLMNANPC1 | |
| SCHEMBL28359072 | 0.74 | ALDH1A1 (0.51) | ALDH1A1POLBMAPTLMNACYP2C19 | |
| SCHEMBL3530965 | 0.74 | ALDH1A1 (0.51) | ALDH1A1POLBMAPTLMNACYP2C19 | |
| SCHEMBL397073 | 0.73 | ALDH1A1 (0.48) | ALDH1A1POLBMAPTLMNAPPARG | |
| SCHEMBL27479897 | 0.71 | NR1D1 (0.46) | ALDH1A1POLBMAPTLMNAPPARG | |
| SCHEMBL24891861 | 0.71 | ALDH1A1 (0.46) | ALDH1A1POLBMAPTLMNAPPARG | |
| SCHEMBL10666461 | 0.71 | PPARG (0.45) | ALDH1A1POLBMAPTLMNAPPARG | |
| SCHEMBL9070342 | 0.70 | CYP1A2 (0.61) | ALDH1A1POLBMAPTNPC1RAB9A | |
| SCHEMBL7717482 | 0.70 | POLB (0.61) | ALDH1A1POLBMAPTRECQLCYP2C19 |
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-1377543-A1 | OXALIC ACID DERIVATIVES | MERCK PATENT GmbH (DE) | 2004-01-07 | — | — | EP | disclosed |
| WO-2002083630-A1 | OXALIC ACID DERIVATIVES | MERCK PATENT GMBH (DE) | 2002-10-24 | — | — | WO | disclosed |