Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 11/20 | 0.54 |
| ▸ | HCK | P08631 | 9/20 | 0.54 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | HPGDS | O60760 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CLK1 | P49759 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.39 |
| ▸ | LCK | P06239 | 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 | |
|---|---|---|---|---|
| SCHEMBL144366 | 0.81 | ITK (0.52) | BTKRAB9ANPC1CYP1A2CYP3A4 | |
| SCHEMBL144365 | 0.81 | ITK (0.52) | BTKRAB9ANPC1CYP1A2CYP3A4 | |
| SCHEMBL30248309 | 0.74 | CYP2C19 (0.55) | RAB9ANPC1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL30248193 | 0.74 | CYP2C19 (0.55) | RAB9ANPC1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL889065 | 0.72 | USP30 (0.53) | RAB9ANPC1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL19205330 | 0.70 | BTK (1.00) | BTKHCK | |
| SCHEMBL19205442 | 0.70 | BTK (1.00) | BTKHCK | |
| SCHEMBL19205329 | 0.70 | BTK (1.00) | BTKHCK | |
| SCHEMBL140852 | 0.70 | LCK (0.66) | BTKRAB9ANPC1DYRK1ALRRK2 | |
| SCHEMBL140851 | 0.70 | LCK (0.66) | BTKRAB9ANPC1DYRK1ALRRK2 |
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-2012035055-A1 | NOVEL COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2012-03-22 | — | — | WO | disclosed |