Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 2/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.48 |
| ▸ | MTOR | P42345 | 1/20 | 0.44 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 3/20 | 0.40 |
| ▸ | PLAU | P00749 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | WNT3A | P56704 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.38 |
| ▸ | TYK2 | P29597 | 1/20 | 0.38 |
| ▸ | MINK1 | Q8N4C8 | 1/20 | 0.38 |
| ▸ | SRPK1 | Q96SB4 | 1/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | IGF1R | P08069 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL13804176 | 0.78 | CYP1A2 (0.54) | CHEK1CYP1A2CYP2A6PDPK1MTOR | |
| SCHEMBL25242404 | 0.78 | PDPK1 (0.54) | CHEK1CYP1A2CYP2A6PDPK1MTOR | |
| Hydrochloric Acid SCHEMBL7398907 | 0.77 | CYP1A2 (0.52) | CHEK1CYP1A2CYP2A6PDPK1MTOR | |
| SCHEMBL1486301 | 0.75 | CHEK1 (0.50) | CHEK1CYP1A2CYP2A6PDPK1MTOR | |
| SCHEMBL1922139 | 0.75 | PDGFRB (0.56) | CHEK1CYP1A2CYP2A6PDPK1NPC1 | |
| SCHEMBL12915410 | 0.75 | CYP1A2 (0.50) | CHEK1CYP1A2CYP2A6PDPK1MTOR | |
| SCHEMBL211712 | 0.74 | CHEK1 (0.49) | CHEK1CYP1A2CYP2A6PDPK1MTOR | |
| SCHEMBL6684693 | 0.74 | CHEK1 (0.49) | CHEK1CYP1A2CYP2A6PDPK1MTOR | |
| SCHEMBL14599973 | 0.74 | CYP1A2 (0.48) | CHEK1CYP1A2CYP2A6PDPK1MTOR | |
| SCHEMBL28512102 | 0.74 | USP30 (0.49) | CHEK1CYP1A2CYP2A6PDPK1MTOR |
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-2231641-A2 | QUINOXALINE AND QUINOLINE DERIVATIVES AS KINASE INHIBITORS | UCB Pharma, S.A. (BE) | 2010-09-29 | — | — | EP | disclosed |
| WO-2009081105-A2 | QUINOXALINE AND QUINOLINE DERIVATIVES AS KINASE INHIBITORS | UCB PHARMA S.A. (BE) | 2009-07-02 | — | — | WO | disclosed |
| EP-1427421-A1 | 2,4-DISUBSTITUTED PYRIMIDINYL DERIVATIVES FOR USE AS ANTICANCER AGENTS | Amgen Inc. (US) | 2004-06-16 | — | — | EP | disclosed |
| WO-2003018021-A1 | 2,4-DISUBSTITUTED PYRIMIDINYL DERIVATIVES FOR USE AS ANTICANCER AGENTS | AMGEN INC. (US) | 2003-03-06 | — | — | WO | disclosed |