Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 3/20 | 0.51 |
| ▸ | GLB1 | P16278 | 1/20 | 0.44 |
| ▸ | GBA2 | Q9HCG7 | 1/20 | 0.44 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.41 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4736763 | 0.85 | GBA1 (0.60) | GBA1GLB1GBA2 | |
| SCHEMBL7226927 | 0.83 | GBA1 (0.68) | GBA1SLC18A3 | |
| Hydrochloric Acid SCHEMBL1573427 | 0.83 | GBA1 (0.58) | GBA1GLB1GBA2 | |
| Hydrochloric Acid SCHEMBL1573431 | 0.83 | GBA1 (0.58) | GBA1GLB1GBA2 | |
| SCHEMBL28087368 | 0.80 | TAAR1 (0.43) | — | |
| SCHEMBL7863360 | 0.78 | GBA1 (0.49) | GBA1SLC18A3 | |
| SCHEMBL7863048 | 0.78 | GBA1 (0.49) | GBA1SLC18A3 | |
| SCHEMBL7863363 | 0.78 | GBA1 (0.49) | GBA1SLC18A3 | |
| SCHEMBL7863044 | 0.78 | GBA1 (0.49) | GBA1SLC18A3 | |
| SCHEMBL7863046 | 0.78 | GBA1 (0.49) | GBA1SLC18A3 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104955824-B | It is used as the aminopyrimidine compounds of the inhibitor of the EGFR mutant containing T790M | 豪夫迈·罗氏有限公司 | 2017-09-22 | — | — | CN | disclosed |
| CN-104918935-B | dihydropyrazole GPR40 modulators | 百时美施贵宝公司 | 2017-07-28 | — | — | CN | disclosed |
| CN-105408327-A | Substituted benzoxazoles | Bayer Pharma AG | 2016-03-16 | — | — | CN | disclosed |
| CN-104955824-A | Aminopyrimidine compounds as inhibitors of t790m containing egfr mutants | GENENTECH INC | 2015-09-30 | — | — | CN | disclosed |
| CN-104918935-A | Dihydropyrazole gpr40 modulators | BRISTOL MYERS SQUIBB CO | 2015-09-16 | — | — | CN | disclosed |