Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | PTGES | O14684 | 3/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.32 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.31 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.31 |
| ▸ | DRD3 | P35462 | 2/20 | 0.31 |
| ▸ | HTR4 | Q13639 | 2/20 | 0.31 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.31 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.31 |
| ▸ | HTR3B | O95264 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MPO | P05164 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27965073 | 0.85 | NPC1 (0.39) | HTTRAB9APTGESLMNA | |
| SCHEMBL671609 | 0.74 | KDM4E (0.36) | LRRK2HTTMKNK2ALDH1A1LMNA | |
| SCHEMBL11951408 | 0.74 | PRKCI (0.40) | MKNK2 | |
| SCHEMBL1725449 | 0.73 | PTGES (0.47) | LRRK2PTGESALDH1A1DRD3HTR4 | |
| SCHEMBL1725448 | 0.73 | PTGES (0.47) | LRRK2PTGESALDH1A1DRD3HTR4 | |
| SCHEMBL670579 | 0.73 | ALDH1A1 (0.40) | ALDH1A1LMNAMAPK1SMN1; SMN2 | |
| SCHEMBL27921182 | 0.73 | NPC1 (0.43) | HTR2AHTTHDAC3HDAC1ALDH1A1 | |
| SCHEMBL11951461 | 0.71 | TAS1R3 (0.42) | RAB9APTGESALDH1A1DRD3HTR4 | |
| SCHEMBL1726279 | 0.70 | PTGES (0.49) | HTTRAB9APTGESALDH1A1CYP1A2 | |
| SCHEMBL7814531 | 0.68 | ALDH1A1 (0.52) | HTR2ARAB9AALDH1A1CYP1A2ADRA2A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102341395-B | 3H-imidazo [4,5-c ] pyridine-6-carboxamides as anti-inflammatory agents | BOEHRINGER INGELHEIM INT | 2014-07-30 | — | — | CN | disclosed |