Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.60 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.60 |
| ▸ | S1PR3 | Q99500 | 2/20 | 0.60 |
| ▸ | S1PR1 | P21453 | 14/20 | 0.56 |
| ▸ | SGPL1 | O95470 | 7/20 | 0.56 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.55 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL11141411 | 1.00 | CYP3A4 (0.60) | CYP3A4CYP2C8S1PR3S1PR1SGPL1 | |
| SCHEMBL11134621 | 0.99 | CYP3A4 (0.62) | CYP3A4CYP2C8S1PR3S1PR1SGPL1 | |
| SCHEMBL11143869 | 0.99 | CYP3A4 (0.62) | CYP3A4CYP2C8S1PR3S1PR1SGPL1 | |
| SCHEMBL11139847 | 0.99 | CYP3A4 (0.62) | CYP3A4CYP2C8S1PR3S1PR1SGPL1 | |
| SCHEMBL11139590 | 0.99 | CYP3A4 (0.62) | CYP3A4CYP2C8S1PR3S1PR1SGPL1 | |
| SCHEMBL11135076 | 0.99 | CYP3A4 (0.62) | CYP3A4CYP2C8S1PR3S1PR1SGPL1 | |
| SCHEMBL11141325 | 0.99 | CYP3A4 (0.62) | CYP3A4CYP2C8S1PR3S1PR1SGPL1 | |
| SCHEMBL11145166 | 0.97 | CYP3A4 (0.62) | CYP3A4CYP2C8S1PR3S1PR1SGPL1 | |
| SCHEMBL11138101 | 0.96 | CYP3A4 (0.64) | CYP3A4CYP2C8S1PR3S1PR1SGPL1 | |
| SCHEMBL11141540 | 0.96 | CYP3A4 (0.64) | CYP3A4CYP2C8S1PR3S1PR1SGPL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4386007-A | ELECTROOPTIC DISPLAY | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1983-05-31 | — | — | US | disclosed |