Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 15/20 | 0.69 |
| ▸ | CD69 | Q07108 | 2/20 | 0.58 |
| ▸ | JAK2 | O60674 | 1/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.58 |
| ▸ | HRH2 | P25021 | 1/20 | 0.58 |
| ▸ | CDK7 | P50613 | 1/20 | 0.58 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.58 |
| ▸ | MAP3K19 | Q56UN5 | 1/20 | 0.58 |
| ▸ | CDKL2 | Q92772 | 1/20 | 0.58 |
| ▸ | RIOK1 | Q9BRS2 | 1/20 | 0.58 |
| ▸ | RIOK2 | Q9BVS4 | 1/20 | 0.58 |
| ▸ | BMP2K | Q9NSY1 | 1/20 | 0.58 |
| ▸ | ABL1 | P00519 | 2/20 | 0.36 |
| ▸ | BCR | P11274 | 2/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16793876 | 0.81 | BTK (0.85) | BTKCD69JAK2CYP3A4HRH2 | |
| SCHEMBL16793761 | 0.79 | BTK (0.72) | BTKCD69JAK2CYP3A4HRH2 | |
| SCHEMBL16794206 | 0.77 | BTK (0.71) | BTKCD69JAK2CYP3A4HRH2 | |
| SCHEMBL16794271 | 0.76 | BTK (0.59) | BTKCD69JAK2CYP3A4HRH2 | |
| SCHEMBL16794321 | 0.75 | BTK (0.78) | BTKCD69JAK2CYP3A4HRH2 | |
| SCHEMBL16794292 | 0.74 | BTK (0.84) | BTKCD69JAK2CYP3A4HRH2 | |
| SCHEMBL29676750 | 0.73 | BTK (0.69) | BTKCD69JAK2CYP3A4HRH2 | |
| SCHEMBL16794224 | 0.73 | BTK (0.69) | BTKCD69JAK2CYP3A4HRH2 | |
| SCHEMBL16793996 | 0.73 | BTK (1.00) | BTKCD69JAK2CYP3A4HRH2 | |
| SCHEMBL16794435 | 0.72 | BTK (0.85) | BTKCD69JAK2CYP3A4HRH2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3080103-A1 | BIARYL COMPOUNDS USEFUL FOR THE TREATMENT OF HUMAN DISEASES IN ONCOLOGY, NEUROLOGY AND IMMUNOLOGY | Biogen MA Inc. (US) | 2016-10-19 | — | — | EP | disclosed |
| WO-2015089337-A1 | BIARYL COMPOUNDS USEFUL FOR THE TREATMENT OF HUMAN DISEASES IN ONCOLOGY, NEUROLOGY AND IMMUNOLOGY | BIOGEN IDEC MA INC. (US) | 2015-06-18 | — | — | WO | disclosed |