Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIA1 | P42261 | 1/20 | 0.48 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.48 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.48 |
| ▸ | HRH3 | Q9Y5N1 | 9/20 | 0.47 |
| ▸ | MMP2 | P08253 | 2/20 | 0.44 |
| ▸ | MMP3 | P08254 | 1/20 | 0.44 |
| ▸ | HRH2 | P25021 | 3/20 | 0.43 |
| ▸ | HRH1 | P35367 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ACACB | O00763 | 2/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL11523862 | 1.00 | GRIA1 (0.48) | GRIA1GRIA2GRIA3HRH3MMP2 | |
| SCHEMBL11522407 | 0.87 | HRH3 (0.46) | GRIA1GRIA2GRIA3HRH3MMP2 | |
| SCHEMBL11522402 | 0.87 | HRH3 (0.46) | GRIA1GRIA2GRIA3HRH3MMP2 | |
| SCHEMBL11521381 | 0.85 | TDP1 (0.47) | GRIA1GRIA2GRIA3HRH3HRH2 | |
| SCHEMBL11521375 | 0.85 | TDP1 (0.47) | GRIA1GRIA2GRIA3HRH3HRH2 | |
| SCHEMBL868642 | 0.85 | MMP2 (0.54) | HRH3MMP2MMP3ALDH1A1HPGD | |
| SCHEMBL11523891 | 0.85 | GRIA1 (0.44) | GRIA1GRIA2GRIA3HRH3MMP2 | |
| SCHEMBL11523895 | 0.85 | GRIA1 (0.44) | GRIA1GRIA2GRIA3HRH3MMP2 | |
| SCHEMBL11524666 | 0.83 | HRH3 (0.48) | GRIA1GRIA2GRIA3HRH3HRH2 | |
| SCHEMBL11524662 | 0.83 | HRH3 (0.48) | GRIA1GRIA2GRIA3HRH3HRH2 |
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-4154697-A | Liquid crystalline hexahydroterphenyl derivatives | MERCK PATENT GESELLSCHAFT MIT BESCHRAENKTER HAFTUNG (DE) | 1979-05-15 | — | — | US | disclosed |