Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.57 |
| ▸ | NOS3 | P29474 | 1/20 | 0.50 |
| ▸ | NOS1 | P29475 | 1/20 | 0.50 |
| ▸ | NOS2 | P35228 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.46 |
| ▸ | EPAS1 | Q99814 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL10077424 | 0.85 | HRH3 (0.59) | HRH3SMN1; SMN2NOS3NOS1NOS2 | |
| SCHEMBL18538130 | 0.84 | HRH3 (0.57) | HRH3SMN1; SMN2NOS3NOS1NOS2 | |
| SCHEMBL18538137 | 0.84 | HRH3 (0.57) | HRH3SMN1; SMN2NOS3NOS1NOS2 | |
| SCHEMBL4547887 | 0.83 | HRH3 (0.65) | HRH3SMN1; SMN2NOS3NOS1NOS2 | |
| SCHEMBL16604253 | 0.83 | HRH3 (0.46) | HRH3SMN1; SMN2MAPTALDH1A1LMNA | |
| SCHEMBL15467001 | 0.82 | HRH3 (0.87) | HRH3SMN1; SMN2NOS3NOS1NOS2 | |
| SCHEMBL13531007 | 0.81 | NCF1 (0.57) | HRH3SMN1; SMN2NOS1MAPTALDH1A1 | |
| SCHEMBL16604254 | 0.81 | HRH3 (0.54) | HRH3SMN1; SMN2NOS3NOS1NOS2 | |
| SCHEMBL19441582 | 0.81 | HRH3 (0.62) | HRH3SMN1; SMN2NOS3NOS1NOS2 | |
| SCHEMBL19441606 | 0.81 | HRH3 (0.62) | HRH3SMN1; SMN2NOS3NOS1NOS2 |
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-7956052-B2 | Modulators of ATP-binding cassette transporters | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2011-06-07 | — | — | US | disclosed |