Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIA1 | P42261 | 1/20 | 0.40 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.40 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.40 |
| ▸ | SPHK1 | Q9NYA1 | 10/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | USP30 | Q70CQ3 | 3/20 | 0.36 |
| ▸ | SPHK2 | Q9NRA0 | 6/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11523755 | 1.00 | GRIA1 (0.40) | GRIA1GRIA2GRIA3SPHK1TSHR | |
| SCHEMBL29834913 | 0.88 | TSHR (0.49) | TSHRHSD17B10CYP2A6 | |
| SCHEMBL11617719 | 0.87 | SPHK1 (0.40) | SPHK1SPHK2 | |
| SCHEMBL11624592 | 0.85 | GRIA1 (0.40) | GRIA1GRIA2GRIA3SPHK1TSHR | |
| SCHEMBL11523258 | 0.82 | HRH3 (0.39) | GRIA1GRIA2GRIA3 | |
| SCHEMBL11523252 | 0.82 | HRH3 (0.39) | GRIA1GRIA2GRIA3 | |
| SCHEMBL11523074 | 0.81 | TSHR (0.40) | GRIA1GRIA2GRIA3TSHRHSD17B10 | |
| SCHEMBL11523068 | 0.81 | TSHR (0.40) | GRIA1GRIA2GRIA3TSHRHSD17B10 | |
| SCHEMBL11618956 | 0.81 | GRIA1 (0.38) | GRIA1GRIA2GRIA3TSHRUSP30 | |
| SCHEMBL11283582 | 0.81 | BDKRB2 (0.41) | SPHK1SPHK2 |
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 |