Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 2/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.56 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.48 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | BRAF | P15056 | 1/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.44 |
| ▸ | PRKDC | P78527 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL18800468 | 0.87 | BTK (0.49) | BTKCYP1A2CYP3A4MAPK1CYP2C19 | |
| SCHEMBL18800760 | 0.86 | BTK (0.61) | BTKCYP1A2CYP3A4MAPK1CYP2C19 | |
| SCHEMBL18800786 | 0.85 | RAPGEF4 (0.44) | BTKCYP1A2CYP3A4MAPK1CYP2C19 | |
| SCHEMBL18800466 | 0.83 | DHODH (0.42) | BTKCYP1A2CYP3A4MAPK1CYP2C19 | |
| SCHEMBL18800792 | 0.77 | BTK (0.47) | BTKADORA2AADORA1LMNAFGFR1 | |
| SCHEMBL18800769 | 0.77 | ADORA2A (0.48) | BTKMAPK1HSD17B10ADORA2AADORA1 | |
| SCHEMBL18800891 | 0.76 | BTK (0.62) | BTKADORA2AADORA1MEN1KMT2A | |
| SCHEMBL18800784 | 0.75 | BTK (0.46) | BTKADORA2AADORA1ATRDYRK1A | |
| SCHEMBL18800559 | 0.74 | BTK (0.58) | BTKMAPK1MEN1KMT2ATSHR | |
| SCHEMBL6115583 | 0.74 | BTK (1.00) | BTKCYP1A2CYP3A4MAPK1CYP2C19 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2789615-B1 | Azaindazoles as Btk kinase modulators and use thereof | BRISTOL MYERS SQUIBB CO (US) | 2017-05-03 | — | — | EP | disclosed |