Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC16A3 | O15427 | 9/20 | 0.58 |
| ▸ | SLC16A1 | P53985 | 6/20 | 0.58 |
| ▸ | MCTS1 | Q9ULC4 | 5/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.57 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.55 |
| ▸ | PPARA | Q07869 | 7/20 | 0.49 |
| ▸ | PPARD | Q03181 | 6/20 | 0.49 |
| ▸ | PPARG | P37231 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL9831414 | 0.78 | SMN1; SMN2 (0.56) | SLC16A3SLC16A1MCTS1MAPTPOLB | |
| SCHEMBL9831115 | 0.75 | NOTUM (0.55) | SLC16A3SLC16A1MCTS1CYP1A2CYP2D6 | |
| SCHEMBL9830073 | 0.75 | SLC16A3 (0.55) | SLC16A3SLC16A1MCTS1PPARAPPARG | |
| Clobuzarit SCHEMBL187456 | 0.74 | SLC16A3 (0.62) | SLC16A3SLC16A1MCTS1CYP1A2CYP2D6 | |
| SCHEMBL1220800 | 0.74 | NOTUM (0.56) | CYP1A2CYP2C9CYP2D6CYP2C19MAPT | |
| SCHEMBL20507192 | 0.73 | NOTUM (0.63) | CYP1A2CYP2C9CYP2D6CYP2C19MAPT | |
| SCHEMBL18307419 | 0.73 | SLC16A3 (1.00) | SLC16A3SLC16A1MCTS1 | |
| SCHEMBL5442956 | 0.72 | NOTUM (1.00) | CYP1A2CYP2C9CYP2D6CYP2C19MAPT | |
| SCHEMBL14541437 | 0.72 | NOTUM (0.70) | CYP1A2CYP2C9CYP2D6CYP2C19MAPT | |
| SCHEMBL16579446 | 0.72 | NOTUM (0.55) | CYP1A2CYP2C9CYP2D6CYP2C19MAPT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0220573-B1 | HETEROCYCLIC COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 1991-12-11 | — | — | EP | claimed |
| US-4774253-A | ETHER,-ACIDS, ESTERS OR AMIDES | HOFFMANN-LA ROCHE INC. (US) | 1988-09-27 | — | — | US | claimed |
| EP-0220573-B1 | HETEROCYCLIC COMPOUNDS | F. HOFFMANN-LA ROCHE AG (CH) | 1991-12-11 | — | — | EP | disclosed |
| US-4774253-A | ETHER,-ACIDS, ESTERS OR AMIDES | HOFFMANN-LA ROCHE INC. (US) | 1988-09-27 | — | — | US | disclosed |
| EP-0220573-A1 | Heterocyclic compounds | F. HOFFMANN-LA ROCHE AG (CH) | 1987-05-06 | — | — | EP | disclosed |