Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.38 |
| ▸ | BTK | Q06187 | 2/20 | 0.38 |
| ▸ | ST14 | Q9Y5Y6 | 4/20 | 0.38 |
| ▸ | F2 | P00734 | 3/20 | 0.38 |
| ▸ | PLAU | P00749 | 1/20 | 0.38 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.37 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | TEK | Q02763 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 2/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.35 |
| ▸ | BAX | Q07812 | 1/20 | 0.35 |
| ▸ | USP7 | Q93009 | 3/20 | 0.35 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.35 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.35 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18800606 | 0.88 | NQO2 (0.43) | KMT2ARPS6KA3BTKST14F2 | |
| SCHEMBL18800557 | 0.83 | PRSS1 (0.45) | KMT2ARPS6KA3PRSS1PRSS2PRSS3 | |
| SCHEMBL12874713 | 0.82 | KMT2A (0.35) | MEN1KMT2AESR1ESR2RPS6KA3 | |
| SCHEMBL18800626 | 0.81 | SMN1; SMN2 (0.48) | MEN1KMT2ABTKF2PRSS1 | |
| SCHEMBL18800867 | 0.80 | BTK (0.50) | KMT2ABTKPARP10PRSS1PRSS2 | |
| SCHEMBL18800873 | 0.80 | SCN5A (0.37) | KDR | |
| SCHEMBL18800610 | 0.79 | BTK (0.43) | MEN1KMT2ABTKF2LTA4H | |
| SCHEMBL18800479 | 0.76 | BTK (0.54) | BTKPARP10 | |
| SCHEMBL18800598 | 0.73 | KDM4E (0.51) | F2PLAUPRSS1 | |
| SCHEMBL18800614 | 0.73 | ERBB2 (0.42) | — |
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 |