Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 3/20 | 0.38 |
| ▸ | FLT3 | P36888 | 1/20 | 0.34 |
| ▸ | MERTK | Q12866 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 3/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 2/20 | 0.31 |
| ▸ | HTR1A | P08908 | 2/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.31 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.31 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL18645735 | 0.74 | THRB (0.34) | PARP1MAOBMAOA | |
| SCHEMBL18644586 | 0.71 | PARP1 (0.38) | PARP1CHEK1 | |
| SCHEMBL18614388 | 0.71 | LMNA (0.32) | FLT3MERTK | |
| SCHEMBL18644574 | 0.68 | BRD4 (0.35) | MAOBMAOASLC6A4 | |
| SCHEMBL18644562 | 0.67 | PARP1 (0.38) | PARP1CHEK1 | |
| SCHEMBL18614494 | 0.66 | MAPT (0.33) | — | |
| SCHEMBL18645191 | 0.66 | — | — | |
| SCHEMBL8218553 | 0.65 | MAOB (0.71) | MAOBMAOA | |
| SCHEMBL19436481 | 0.64 | TSHR (0.43) | FLT3MERTKCHEK1 | |
| SCHEMBL16372584 | 0.64 | KDM4E (0.44) | MAOBMAOAHTR1ASLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017042182-A1 | TRICYCLIC PI3K INHIBITOR COMPOUNDS AND METHODS OF USE | F. HOFFMANN-LA ROCHE AG (CH) | 2017-03-16 | — | — | WO | disclosed |