Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.69 |
| ▸ | SMO | Q99835 | 4/20 | 0.64 |
| ▸ | USP28 | Q96RU2 | 8/20 | 0.63 |
| ▸ | ALB | P02768 | 1/20 | 0.63 |
| ▸ | HTR1A | P08908 | 1/20 | 0.63 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.63 |
| ▸ | PDE4A | P27815 | 1/20 | 0.63 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.63 |
| ▸ | DRD3 | P35462 | 1/20 | 0.63 |
| ▸ | HTR2B | P41595 | 1/20 | 0.63 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.63 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.63 |
| ▸ | SHH | Q15465 | 1/20 | 0.63 |
| ▸ | SLC29A1 | Q99808 | 1/20 | 0.63 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.63 |
| ▸ | GAA | P10253 | 2/20 | 0.57 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.57 |
| ▸ | GPR27 | Q9NS67 | 1/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL10238306 | 0.90 | MAPT (0.65) | MAPTSMOGAATP53MEN1 | |
| SCHEMBL402828 | 0.88 | TSHR (0.62) | MAPTSMOUSP28ALBHTR1A | |
| SCHEMBL10238371 | 0.82 | MAPT (1.00) | MAPTSMOTP53ALDH1A1CYP2C19 | |
| SCHEMBL3790049 | 0.82 | MAPT (0.83) | MAPTSMOTP53MEN1ALDH1A1 | |
| SCHEMBL28899120 | 0.80 | SMO (0.68) | MAPTSMOUSP28ALBHTR1A | |
| SCHEMBL14551128 | 0.78 | AVPR2 (0.71) | MAPTSMOUSP28ALBHTR1A | |
| SCHEMBL403822 | 0.78 | TSHR (0.67) | MAPTGAAMEN1ALDH1A1KMT2A | |
| SCHEMBL12917375 | 0.78 | SMO (0.68) | MAPTSMOUSP28ALBHTR1A | |
| Vismodegib SCHEMBL302587 | 0.78 | USP28 (1.00) | SMOUSP28ALBHTR1ASLC6A2 | |
| Vismodegib SCHEMBL29352323 | 0.78 | USP28 (1.00) | SMOUSP28ALBHTR1ASLC6A2 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9910050-B2 | Mutant smoothened and methods of using the same | GENENTECH, INC. (US) | 2018-03-06 | — | — | US | disclosed |
| US-20160313354-A1 | MUTANT SMOOTHENED AND METHODS OF USING THE SAME | GENENTECH, INC. | 2016-10-27 | — | — | US | disclosed |
| EP-2473522-B1 | MUTANT SMOOTHENED AND METHODS OF USING THE SAME | GENENTECH INC (US) | 2016-08-17 | — | — | EP | disclosed |
| EP-2625197-B1 | MUTANT SMOOTHENED AND METHODS OF USING THE SAME | GENENTECH INC (US) | 2016-06-29 | — | — | EP | disclosed |
| US-9321823-B2 | Mutant smoothened and methods of using the same | GENENTECH, INC. (US) | 2016-04-26 | — | — | US | disclosed |
| US-9096686-B2 | E518A/K mutant smoothened and methods of using the same | GENENTECH, INC. (US) | 2015-08-04 | — | — | US | disclosed |
| US-8481680-B2 | Mutant smoothened and methods of using the same | GENENTECH, INC. (US) | 2013-07-09 | — | — | US | disclosed |