Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 2/20 | 0.51 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28290801 | 0.87 | RAB9A (0.53) | SMN1; SMN2ALDH1A1NPC1CYP2C19MEN1 | |
| SCHEMBL28289352 | 0.85 | RAB9A (0.53) | SMN1; SMN2ALDH1A1NPC1EPHX2KMT2A | |
| SCHEMBL2944396 | 0.84 | ALDH1A1 (0.59) | SMN1; SMN2ALDH1A1NPC1EPHX2CYP2C19 | |
| SCHEMBL2949436 | 0.84 | ALDH1A1 (0.59) | SMN1; SMN2ALDH1A1NPC1EPHX2CYP2C19 | |
| SCHEMBL1790000 | 0.84 | ALDH1A1 (0.59) | SMN1; SMN2ALDH1A1NPC1EPHX2CYP2C19 | |
| SCHEMBL22453473 | 0.83 | ALDH1A1 (0.56) | SMN1; SMN2ALDH1A1NPC1EPHX2CYP2C19 | |
| SCHEMBL16684739 | 0.82 | HDAC8 (0.61) | SMN1; SMN2ALDH1A1NPC1EPHX2CYP2C19 | |
| SCHEMBL14220967 | 0.81 | SMN1; SMN2 (0.52) | SMN1; SMN2ALDH1A1NPC1EPHX2CYP2C19 | |
| SCHEMBL15214831 | 0.80 | ALDH1A1 (0.56) | SMN1; SMN2ALDH1A1NPC1EPHX2CYP2C19 | |
| SCHEMBL12488363 | 0.79 | HDAC1 (0.56) | SMN1; SMN2ALDH1A1NPC1EPHX2CYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110003104-A | Salicyclic acid derivatives, its pharmaceutically acceptable salt, its composition and its application method | 多伦多大学管理委员会 | 2019-07-12 | — | — | CN | disclosed |
| CN-105120854-B | Novel salicylic acid derivatives, pharmaceutically acceptable salts thereof, compositions thereof, and methods of use thereof | 多伦多大学管理委员会 | 2019-04-09 | — | — | CN | disclosed |