Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.94 |
| ▸ | GABRP | O00591 | 1/20 | 0.94 |
| ▸ | GABRD | O14764 | 1/20 | 0.94 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.94 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.94 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.94 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.94 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.94 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.94 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.94 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.94 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.94 |
| ▸ | GABRE | P78334 | 1/20 | 0.94 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.94 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.94 |
| ▸ | GABRG1 | Q8N1C3 | 1/20 | 0.94 |
| ▸ | GABRG3 | Q99928 | 1/20 | 0.94 |
| ▸ | GABRQ | Q9UN88 | 1/20 | 0.94 |
| ▸ | SLC6A1 | P30531 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Isonipecotic Acid SCHEMBL2027408 | 0.97 | TSHR (1.00) | TSHRGABRPGABRDGABRA1GABRB1 | |
| Isonipecotic Acid SCHEMBL104297 | 0.97 | — | — | |
| Isonipecotic Acid SCHEMBL31602943 | 0.94 | TSHR (0.94) | TSHRGABRPGABRDGABRA1GABRB1 | |
| Isonipecotic Acid SCHEMBL30060745 | 0.94 | TSHR (0.94) | TSHRGABRPGABRDGABRA1GABRB1 | |
| Isonipecotic Acid SCHEMBL11556866 | 0.94 | TSHR (0.94) | TSHRGABRPGABRDGABRA1GABRB1 | |
| Isonipecotic Acid SCHEMBL23043998 | 0.94 | TSHR (0.94) | TSHRGABRPGABRDGABRA1GABRB1 | |
| Isonipecotic Acid SCHEMBL1703706 | 0.94 | TSHR (0.94) | TSHRGABRPGABRDGABRA1GABRB1 | |
| Isonipecotic Acid SCHEMBL6122239 | 0.94 | TSHR (0.94) | TSHRGABRPGABRDGABRA1GABRB1 | |
| Isonipecotic Acid SCHEMBL2560208 | 0.94 | TSHR (0.94) | TSHRGABRPGABRDGABRA1GABRB1 | |
| Isonipecotic Acid SCHEMBL28089924 | 0.94 | TSHR (0.94) | TSHRGABRPGABRDGABRA1GABRB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1755593-B1 | NAPHTHALENE DERIVATIVES USEFUL AS HISTAMINE-3-RECEPTOR LIGANDS | HOFFMANN LA ROCHE (CH) | 2008-01-16 | — | — | EP | disclosed |