Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 1/20 | 0.51 |
| ▸ | GBA1 | P04062 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.41 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.41 |
| ▸ | CACNA1H | O95180 | 2/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | JAK1 | P23458 | 1/20 | 0.33 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20599362 | 0.83 | RAB9A (0.41) | FAAHHRH4 | |
| SCHEMBL956707 | 0.81 | RAB9A (0.43) | FAAHHRH3HRH4 | |
| SCHEMBL21978043 | 0.76 | FAAH (0.37) | FAAHLRRK2 | |
| SCHEMBL19023013 | 0.76 | CHRM2 (0.43) | FAAHTDP1SLC6A4 | |
| SCHEMBL28184744 | 0.71 | GBA1 (0.42) | FAAHGBA1HRH3HRH4CACNA1H | |
| SCHEMBL28540047 | 0.70 | CDK2 (0.54) | GBA1HRH3HRH4 | |
| SCHEMBL4356558 | 0.70 | CYP1B1 (0.30) | FAAH | |
| SCHEMBL5688150 | 0.69 | GBA1 (0.52) | FAAHGBA1HRH3HRH4CACNA1H | |
| SCHEMBL25145833 | 0.69 | CACNA1H (0.44) | FAAHGBA1HRH3HRH4CACNA1H | |
| SCHEMBL16400073 | 0.69 | HRH3 (0.42) | GBA1HRH3HRH4TDP1SLC6A4 |
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-105555783-B | Include the autotaxin inhibitors of heteroaromatic rings benzyl amide ring core | 诺华股份有限公司 | 2017-12-01 | — | — | CN | disclosed |
| CN-105555783-A | Autotaxin inhibitors comprising a heteroaromatic ring-benzyl-amide-cycle core | NOVARTIS AG | 2016-05-04 | — | — | CN | disclosed |