Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 7/20 | 0.49 |
| ▸ | NPC1 | O15118 | 6/20 | 0.49 |
| ▸ | RAB9A | P51151 | 6/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 4/20 | 0.49 |
| ▸ | NFKB2 | Q00653 | 4/20 | 0.49 |
| ▸ | RELA | Q04206 | 4/20 | 0.49 |
| ▸ | TP53 | P04637 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | PKM | P14618 | 3/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.47 |
| ▸ | ABL1 | P00519 | 1/20 | 0.47 |
| ▸ | BCR | P11274 | 1/20 | 0.47 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.47 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.47 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.47 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL2075728 | 0.86 | SMN1; SMN2 (0.52) | MAPTUSP2SMN1; SMN2NPC1RAB9A | |
| SCHEMBL2074775 | 0.83 | HDAC3 (0.50) | SMN1; SMN2NPC1ALDH1A1HDAC3ABL1 | |
| SCHEMBL2073004 | 0.77 | KIT (0.49) | SMN1; SMN2RAB9AALDH1A1HDAC3ABL1 | |
| SCHEMBL2075221 | 0.76 | SMN1; SMN2 (0.51) | SMN1; SMN2RAB9AALDH1A1HDAC3ABL1 | |
| SCHEMBL2075163 | 0.76 | SMN1; SMN2 (0.51) | SMN1; SMN2RAB9AALDH1A1HDAC3ABL1 | |
| SCHEMBL2075487 | 0.75 | MAPK1 (0.47) | MAPTSMN1; SMN2ALDH1A1HDAC3ABL1 | |
| SCHEMBL2075182 | 0.74 | KIT (0.46) | MAPTSMN1; SMN2NPC1RAB9AALDH1A1 | |
| SCHEMBL2073422 | 0.72 | KIT (0.45) | SMN1; SMN2RAB9AALDH1A1HDAC3ABL1 | |
| SCHEMBL2075539 | 0.72 | KIT (0.48) | SMN1; SMN2RAB9AALDH1A1HDAC3ABL1 | |
| SCHEMBL2072611 | 0.72 | SMN1; SMN2 (0.73) | SMN1; SMN2NPC1RAB9AALDH1A1HDAC3 |
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 |
|---|---|---|---|---|---|---|---|
| US-7902184-B2 | Piperazinyl pyrimidine derivatives | HOFFMANN-LA ROCHE INC. (US) | 2011-03-08 | — | — | US | disclosed |