Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.38 |
| ▸ | SLC18A3 | Q16572 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.35 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.32 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.32 |
| ▸ | BRD4 | O60885 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL13784881 | 0.87 | SMN1; SMN2 (0.36) | TSHRSIGMAR1SLC18A3 | |
| SCHEMBL12436507 | 0.83 | KDM1A (0.40) | TSHRSIGMAR1MAPTTMEM97MEN1 | |
| SCHEMBL11882825 | 0.77 | TSHR (0.33) | TSHR | |
| SCHEMBL2680294 | 0.76 | TSHR (0.48) | TSHRTAAR1MEN1CYP2C19KMT2A | |
| SCHEMBL7458763 | 0.76 | TSHR (0.48) | TSHRTAAR1MEN1CYP2C19KMT2A | |
| SCHEMBL2680291 | 0.76 | TSHR (0.48) | TSHRTAAR1MEN1CYP2C19KMT2A | |
| SCHEMBL8929934 | 0.76 | ALOX15 (0.36) | SLC18A3MAPT | |
| SCHEMBL9632319 | 0.72 | TSHR (0.52) | TSHRSIGMAR1SLC18A3GAAMAPT | |
| SCHEMBL8212527 | 0.72 | TSHR (0.52) | TSHRSIGMAR1SLC18A3GAAMAPT | |
| SCHEMBL476956 | 0.72 | LPL (0.35) | — |
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-4751017-A | LIQUID CRYSTALS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1988-06-14 | — | — | US | disclosed |