Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 2/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | GNAI3 | P08754 | 9/20 | 0.33 |
| ▸ | GNAO1 | P09471 | 9/20 | 0.33 |
| ▸ | GNAI1 | P63096 | 9/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL20487794 | 0.82 | GNAO1 (0.46) | GBA1CHRM1GNAI3GNAO1GNAI1 | |
| SCHEMBL9741247 | 0.82 | GNAO1 (0.46) | GBA1CHRM1GNAI3GNAO1GNAI1 | |
| SCHEMBL4239877 | 0.81 | GNAO1 (0.43) | GBA1CHRM1GNAI3GNAO1GNAI1 | |
| Hydrochloric Acid SCHEMBL27157910 | 0.79 | GNAO1 (0.46) | GBA1CHRM1GNAI3GNAO1GNAI1 | |
| SCHEMBL3020121 | 0.79 | CHRM1 (0.43) | GBA1CHRM1GNAI3GNAO1GNAI1 | |
| SCHEMBL1326684 | 0.76 | DUT (0.33) | — | |
| SCHEMBL8161878 | 0.73 | CA1 (0.33) | ALDH1A1TDP1 | |
| SCHEMBL19834937 | 0.73 | GBA1 (0.46) | GBA1CHRM1GNAI3GNAO1GNAI1 | |
| SCHEMBL19833602 | 0.73 | GBA1 (0.46) | GBA1CHRM1GNAI3GNAO1GNAI1 | |
| SCHEMBL28641579 | 0.72 | — | — |
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-2569285-A1 | BIFUNCTIONAL QUINOLINE DERIVATIVES | Gilead Sciences, Inc. (US) | 2013-03-20 | — | — | EP | disclosed |
| WO-2011143105-A1 | BIFUNCTIONAL QUINOLINE DERIVATIVES | GILEAD SCIENCES, INC. (US) | 2011-11-17 | — | — | WO | disclosed |