Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.52 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.52 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 2/20 | 0.45 |
| ▸ | MAOB | P27338 | 2/20 | 0.45 |
| ▸ | KDM1A | O60341 | 1/20 | 0.45 |
| ▸ | SCD5 | Q86SK9 | 1/20 | 0.45 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.44 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.44 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5958188 | 0.91 | GRIA1 (0.49) | TSHRHSD11B1MAOAMAOBGRIA1 | |
| SCHEMBL13621591 | 0.85 | GRIA1 (0.46) | HSD11B1MAOAMAOBGRIA1GRIA2 | |
| SCHEMBL21574447 | 0.83 | GRIA1 (0.44) | HSD11B1MAOAMAOBGRIA1GRIA2 | |
| SCHEMBL5592675 | 0.83 | GBA1 (0.49) | MAOAMAOBKDM1AGRIA1GRIA2 | |
| SCHEMBL250894 | 0.83 | MAOA (0.50) | MAOAMAOBGRIA1GRIA2GRIA3 | |
| SCHEMBL3706669 | 0.83 | KCNH2 (0.46) | MAOAMAOBGRIA1GRIA2GRIA3 | |
| SCHEMBL23197880 | 0.82 | GRIA1 (0.43) | HSD11B1MAOAMAOBGRIA1GRIA2 | |
| SCHEMBL7281867 | 0.82 | ESR2 (0.59) | HSD11B1SCD5GRIA1GRIA2GRIA3 | |
| SCHEMBL22816139 | 0.82 | ESR2 (0.59) | HSD11B1SCD5GRIA1GRIA2GRIA3 | |
| SCHEMBL20083485 | 0.82 | ESR2 (0.57) | HSD11B1MAOAMAOBGRIA1GRIA2 |
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 |