Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.54 |
| ▸ | THRB | P10828 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | SLC22A1 | O15245 | 2/20 | 0.41 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | DNM1 | Q05193 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| Hexane SCHEMBL9730168 | 1.00 | TSHR (0.54) | TSHRTHRBLMNASLC22A1SLC22A2 | |
| Hexane SCHEMBL5320530 | 1.00 | TSHR (0.54) | TSHRTHRBLMNASLC22A1SLC22A2 | |
| Hexane SCHEMBL11106986 | 1.00 | TSHR (0.54) | TSHRTHRBLMNASLC22A1SLC22A2 | |
| Hexane SCHEMBL2165324 | 1.00 | TSHR (0.54) | TSHRTHRBLMNASLC22A1SLC22A2 | |
| Hexane SCHEMBL7375762 | 1.00 | TSHR (0.54) | TSHRTHRBLMNASLC22A1SLC22A2 | |
| Hexane SCHEMBL4953906 | 1.00 | TSHR (0.54) | TSHRTHRBLMNASLC22A1SLC22A2 | |
| Hexane SCHEMBL4268972 | 1.00 | TSHR (0.54) | TSHRTHRBLMNASLC22A1SLC22A2 | |
| Hexane SCHEMBL7917492 | 1.00 | TSHR (0.54) | TSHRTHRBLMNASLC22A1SLC22A2 | |
| Hexane SCHEMBL14814561 | 1.00 | TSHR (0.54) | TSHRTHRBLMNASLC22A1SLC22A2 | |
| Hexane SCHEMBL1110546 | 1.00 | TSHR (0.54) | TSHRTHRBLMNASLC22A1SLC22A2 |
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-5444082-A | Treats hypertension and heart failure | SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) | 1995-08-22 | — | — | US | disclosed |