Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRBN | Q96SW2 | 2/20 | 0.47 |
| ▸ | TDP2 | O95551 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | PGR | P06401 | 3/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.42 |
| ▸ | CAPN9 | O14815 | 1/20 | 0.42 |
| ▸ | CASP3 | P42574 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | PNMT | P11086 | 1/20 | 0.41 |
| ▸ | OTUD7B | Q6GQQ9 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL26087941 | 0.88 | CRBN (0.47) | CRBNTDP2CYP3A4ALDH1A1CYP2C9 | |
| SCHEMBL260824 | 0.76 | CRBN (0.53) | CRBNTDP2CYP3A4CA12CA1 | |
| SCHEMBL2993057 | 0.74 | TDP2 (0.67) | TDP2CYP3A4ALDH1A1PGRCAPN9 | |
| SCHEMBL17252079 | 0.74 | CMA1 (0.54) | TDP2OTUD7B | |
| SCHEMBL260822 | 0.74 | TDP2 (0.47) | CRBNTDP2CYP3A4CA12CA1 | |
| SCHEMBL495833 | 0.73 | CA9 (0.56) | CRBNTDP2CYP3A4PGRCA9 | |
| SCHEMBL30270534 | 0.73 | CA9 (0.56) | CRBNTDP2CYP3A4PGRCA9 | |
| SCHEMBL15578816 | 0.73 | PGR (0.62) | TDP2CYP3A4ALDH1A1CYP2C9CYP2C19 | |
| SCHEMBL3604126 | 0.72 | TDP2 (0.48) | TDP2CYP3A4AKR1B1CAPN9CASP3 | |
| SCHEMBL31491273 | 0.72 | TDP2 (0.48) | TDP2CYP3A4AKR1B1CAPN9CASP3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1814878-B1 | SPIRO-2, 4-PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES | RIGEL PHARMACEUTICALS INC (US) | 2012-01-04 | — | — | EP | disclosed |