Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | QDPR | P09417 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 4/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.43 |
| ▸ | JAK2 | O60674 | 2/20 | 0.40 |
| ▸ | TLR9 | Q9NR96 | 7/20 | 0.40 |
| ▸ | TLR8 | Q9NR97 | 7/20 | 0.40 |
| ▸ | TLR7 | Q9NYK1 | 7/20 | 0.40 |
| ▸ | ALK | Q9UM73 | 3/20 | 0.40 |
| ▸ | INSR | P06213 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.40 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 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 | |
|---|---|---|---|---|
| SCHEMBL310290 | 0.84 | HTR2C (0.55) | QDPRHTR2CCHEK1TLR9TLR7 | |
| Hydrochloric Acid SCHEMBL3319085 | 0.83 | HTR2C (0.56) | QDPRHTR2CCHEK1TLR9TLR7 | |
| SCHEMBL12705532 | 0.81 | PDE4A (0.48) | PDE4B | |
| SCHEMBL12705251 | 0.81 | QDPR (0.52) | QDPRCHEK1TLR9TLR8TLR7 | |
| SCHEMBL17580522 | 0.80 | CCR5 (0.39) | QDPRCHEK1TLR9TLR8TLR7 | |
| SCHEMBL5584880 | 0.79 | SLC6A4 (0.45) | QDPRHTR2CJAK2TLR9TLR8 | |
| SCHEMBL17580368 | 0.79 | ADRA1D (0.39) | QDPRTLR9TLR8TLR7SLC18A3 | |
| SCHEMBL17580465 | 0.78 | POLB (0.33) | HTR2CCHEK1TLR8 | |
| Tert-Butyl Formate SCHEMBL28107870 | 0.77 | TLR7 (0.39) | QDPRHTR2CJAK2TLR9TLR8 | |
| SCHEMBL17304068 | 0.76 | POLB (0.42) | TLR8PDE4B |
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-2537830-A1 | Compounds and compositions as protein kinase inhibitors | IRM LLC (BM) | 2012-12-26 | — | — | EP | disclosed |
| EP-2311807-A1 | Compounds and composition as protein kinase inhibitors | IRM LLC (BM) | 2011-04-20 | — | — | EP | disclosed |
| WO-2008073687-A2 | COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS | IRM LLC (BM) | 2008-06-19 | — | — | WO | disclosed |