Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 4/20 | 0.33 |
| ▸ | DHFR | P00374 | 1/20 | 0.33 |
| ▸ | KDR | P35968 | 2/20 | 0.32 |
| ▸ | EGFR | P00533 | 3/20 | 0.31 |
| ▸ | ITK | Q08881 | 1/20 | 0.31 |
| ▸ | BRAF | P15056 | 3/20 | 0.31 |
| ▸ | SYK | P43405 | 6/20 | 0.31 |
| ▸ | BTK | Q06187 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL656886 | 0.78 | EGFR (0.52) | KDREGFRITKSYKBTK | |
| SCHEMBL4407974 | 0.72 | MEN1 (0.39) | EGFRSYK | |
| SCHEMBL27612940 | 0.70 | EGFR (0.36) | EGFRITKSYK | |
| SCHEMBL27612717 | 0.70 | PIK3CG (0.37) | EGFRBRAF | |
| SCHEMBL656504 | 0.68 | SYK (0.70) | KDREGFRITKSYKBTK | |
| SCHEMBL655493 | 0.68 | SYK (0.70) | KDREGFRITKSYKBTK | |
| SCHEMBL655439 | 0.67 | SYK (0.63) | KDREGFRITKSYKBTK | |
| SCHEMBL654524 | 0.66 | SYK (0.72) | EGFRITKSYKBTK | |
| SCHEMBL655845 | 0.64 | EGFR (0.56) | KDREGFRITKSYKBTK | |
| SCHEMBL14320437 | 0.62 | NPSR1 (0.47) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1471915-A4 | 2,4-PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES | RIGEL PHARMACEUTICALS INC (US) | 2006-02-15 | — | — | EP | disclosed |
| EP-1471915-A2 | 2,4-PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES | Rigel Pharmaceuticals, Inc. (US) | 2004-11-03 | — | — | EP | disclosed |
| WO-2003063794-A2 | 2,4-PYRIMIDINEDIAMINE COMPOUNDS AND THEIR USES | RIGEL PHARMACEUTICALS, INC. (US) | 2003-08-07 | — | — | WO | disclosed |