Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LCK | P06239 | 3/20 | 0.84 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.84 |
| ▸ | WEE1 | P30291 | 7/20 | 0.62 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.54 |
| ▸ | SRC | P12931 | 4/20 | 0.54 |
| ▸ | HCK | P08631 | 1/20 | 0.54 |
| ▸ | RIPK2 | O43353 | 8/20 | 0.53 |
| ▸ | NOD2 | Q9HC29 | 8/20 | 0.53 |
| ▸ | ACVR1 | Q04771 | 6/20 | 0.53 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.53 |
| ▸ | JAK2 | O60674 | 1/20 | 0.53 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.53 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.53 |
| ▸ | PAK4 | O96013 | 1/20 | 0.53 |
| ▸ | ABL1 | P00519 | 1/20 | 0.53 |
| ▸ | EGFR | P00533 | 1/20 | 0.53 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.53 |
| ▸ | FYN | P06241 | 1/20 | 0.53 |
| ▸ | CSF1R | P07333 | 1/20 | 0.53 |
| ▸ | RET | P07949 | 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 | |
|---|---|---|---|---|
| SCHEMBL6619078 | 0.92 | LCK (0.79) | LCKMAPK14WEE1FGFR1SRC | |
| SCHEMBL6619817 | 0.91 | LCK (1.00) | LCKMAPK14WEE1FGFR1SRC | |
| SCHEMBL6618651 | 0.90 | LCK (0.75) | LCKMAPK14WEE1FGFR1SRC | |
| SCHEMBL6621118 | 0.89 | LCK (0.81) | LCKMAPK14WEE1FGFR1SRC | |
| SCHEMBL6620735 | 0.88 | LCK (0.80) | LCKMAPK14WEE1FGFR1SRC | |
| SCHEMBL3970429 | 0.88 | LCK (0.65) | LCKMAPK14WEE1FGFR1RIPK2 | |
| SCHEMBL6619659 | 0.87 | LCK (0.91) | LCKMAPK14WEE1FGFR1SRC | |
| SCHEMBL3977883 | 0.85 | LCK (0.61) | LCKMAPK14WEE1FGFR1SRC | |
| SCHEMBL3971251 | 0.85 | LCK (0.60) | LCKMAPK14WEE1FGFR1SRC | |
| Trifluoroacetic Acid SCHEMBL6620520 | 0.84 | LCK (0.67) | LCKMAPK14WEE1FGFR1SRC |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1123295-B1 | BICYCLIC NITROGEN HETEROCYCLES | HOFFMANN LA ROCHE (CH) | 2004-09-29 | — | — | EP | disclosed |
| EP-1123295-A1 | BICYCLIC NITROGEN HETEROCYCLES | F. HOFFMANN-LA ROCHE AG (CH) | 2001-08-16 | — | — | EP | disclosed |
| US-6150373-A | AMINO-SUBSTITUTED DIHYDROPYRIMIDO(4,5-D)PYRIMIDINONE DERIVATIVES; INHIBITORS OF THE T-CELL TYROSINE KINASE P56LCK; IMMUNOSUPPRESSANTS; ANTIINFLAMMATORY/-CARCINOGENIC AGENTS; BRONCHOPULMONARY, DERMATOLOGICAL AND CARDIOVASCULAR DISORDERS | HOFFMANN-LA ROCHE INC. (US) | 2000-11-21 | — | — | US | disclosed |
| WO-2000024744-A1 | BICYCLIC NITROGEN HETEROCYCLES | F. HOFFMANN-LA ROCHE AG (CH) | 2000-05-04 | — | — | WO | disclosed |