Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 2/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.34 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9988801 | 0.81 | CYP2C9 (0.37) | NISCHCYP2C9ATMGSK3BMAOA | |
| SCHEMBL7142349 | 0.73 | LMNA (0.39) | NISCHCYP2C9ATMMAOAMAOB | |
| SCHEMBL29802419 | 0.72 | PARP1 (0.40) | NISCHATMMAOAMAOBMEN1 | |
| SCHEMBL30312068 | 0.72 | PARP1 (0.40) | NISCHATMMAOAMAOBMEN1 | |
| SCHEMBL217432 | 0.72 | PARP1 (0.40) | NISCHATMMAOAMAOBMEN1 | |
| SCHEMBL30785679 | 0.68 | CYP2C9 (0.47) | NISCHCYP2C9ATMMAOAMAOB | |
| SCHEMBL7451378 | 0.68 | CYP2C9 (0.38) | NISCHCYP2C9ATMMAOAMAOB | |
| SCHEMBL831081 | 0.67 | MAOA (0.37) | NISCHCYP2C9ATMMAOAMAOB | |
| SCHEMBL2337529 | 0.66 | GSK3B (0.48) | GSK3BMAOAMAOBALDH1A1L3MBTL1 | |
| SCHEMBL8516771 | 0.65 | MAOA (0.50) | NISCHCYP2C9ATMMAOAMAOB |
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-6514983-B1 | Inhibitors of the nucleic enzyme poly(adenosine 5'-diphospho-ribose)polymerase | GUILFORD PHARMACEUTICALS INC. | 2003-02-04 | — | — | US | disclosed |