Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.36 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.36 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.36 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.36 |
| ▸ | PRCP | P42785 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27475180 | 0.72 | GBA1 (0.51) | GBA1POLBDDB1CRBN | |
| SCHEMBL19693633 | 0.69 | GBA1 (0.51) | GBA1POLBSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL11776789 | 0.69 | GBA1 (0.41) | GBA1TSHRHDAC8DDB1CRBN | |
| SCHEMBL12539609 | 0.67 | GBA1 (0.70) | GBA1POLBSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL9828599 | 0.67 | GBA1 (0.64) | GBA1POLBSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL16616098 | 0.66 | GBA1 (0.47) | GBA1POLBCYP2D6TSHRHDAC8 | |
| SCHEMBL21538623 | 0.65 | GBA1 (0.40) | GBA1POLBCYP3A4CYP2D6TSHR | |
| Hydrochloric Acid SCHEMBL483179 | 0.65 | MAOA (0.37) | GBA1 | |
| Hydrochloric Acid SCHEMBL25411981 | 0.65 | GBA1 (0.50) | GBA1DDB1CRBN | |
| SCHEMBL10073907 | 0.64 | CTSC (0.43) | GBA1DDB1CRBN |
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-2590981-A1 | NOVEL HOMOPIPERAZINE DERIVATIVES AS PROTEIN TYROSINE KINASE INHIBITORS AND PHARMACEUTICAL USE THEREOF | Leo Pharma A/S (DK) | 2013-05-15 | — | — | EP | disclosed |
| WO-2012003829-A1 | NOVEL HOMOPIPERAZINE DERIVATIVES AS PROTEIN TYROSINE KINASE INHIBITORS AND PHARMACEUTICAL USE THEREOF | LEO PHARMA A/S (DK) | 2012-01-12 | — | — | WO | disclosed |