Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LRRK2 | Q5S007 | 3/20 | 0.64 |
| ▸ | RAB9A | P51151 | 5/20 | 0.62 |
| ▸ | NPC1 | O15118 | 4/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.62 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.62 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.62 |
| ▸ | SCD | O00767 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | ATM | Q13315 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.56 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.53 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL5089614 | 0.86 | LRRK2 (0.70) | LRRK2RAB9ANPC1CYP1A2CYP3A4 | |
| SCHEMBL14807437 | 0.86 | MAP3K5 (0.68) | LRRK2RAB9ANPC1CYP1A2CYP3A4 | |
| SCHEMBL4917956 | 0.83 | SCD (0.82) | RAB9ANPC1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL4909164 | 0.82 | MMP13 (0.76) | LRRK2RAB9ANPC1CYP1A2CYP3A4 | |
| SCHEMBL21753719 | 0.78 | LRRK2 (1.00) | LRRK2RAB9ANPC1CYP1A2CYP3A4 | |
| SCHEMBL3708649 | 0.78 | RAB9A (0.76) | LRRK2RAB9ANPC1CYP1A2CYP3A4 | |
| SCHEMBL4915124 | 0.78 | SCD (0.74) | LRRK2RAB9ANPC1CYP1A2CYP3A4 | |
| SCHEMBL16553877 | 0.78 | SCD (0.86) | RAB9ANPC1SCDKDM4EALDH1A1 | |
| SCHEMBL5445832 | 0.78 | HPGDS (0.69) | LRRK2RAB9ANPC1CYP1A2CYP3A4 | |
| SCHEMBL4920257 | 0.78 | NPC1 (0.78) | LRRK2RAB9ANPC1DYRK1ASCD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005037845-A1 | BENZOTHIAZOLE AND THIAZOLE[5,5-B] PYRIDINE COMPOSITIONS AND THEIR USE AS UBIQUITIN LIGASE INHIBITORS | RIGEL PHARMACEUTICALS, INC. (US) | 2005-04-28 | — | — | WO | disclosed |