Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 4/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | RGS12 | O14924 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | APEX1 | P27695 | 1/20 | 0.45 |
| ▸ | CASP1 | P29466 | 1/20 | 0.45 |
| ▸ | BRCA1 | P38398 | 1/20 | 0.45 |
| ▸ | MTOR | P42345 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | BLM | P54132 | 1/20 | 0.45 |
| ▸ | CASP7 | P55210 | 1/20 | 0.45 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.45 |
| ▸ | HBB | P68871 | 1/20 | 0.45 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7896263 | 0.82 | PPOX (0.46) | PARP1MEN1RGS12USP2CYP1A2 | |
| SCHEMBL9769132 | 0.81 | GSK3B (0.47) | PARP1MEN1RGS12USP2CYP1A2 | |
| SCHEMBL11420985 | 0.77 | CES1 (0.44) | MEN1CYP1A2MAPTKMT2AGSK3B | |
| SCHEMBL11423045 | 0.74 | TYMS (0.51) | MEN1CYP1A2KMT2ATDP1WEE1 | |
| SCHEMBL261439 | 0.74 | GSK3B (0.52) | PARP1CASP7GSK3BSTK10SLK | |
| SCHEMBL11533447 | 0.73 | WEE1 (0.37) | PARP1GSK3BSTK10SLKWEE1 | |
| Benzene SCHEMBL28220879 | 0.72 | GSK3B (0.50) | PARP1CASP7GSK3BSTK10SLK | |
| SCHEMBL11430142 | 0.71 | CYP1A2 (0.43) | CYP1A2GSK3BSTK10SLKWEE1 | |
| SCHEMBL13578767 | 0.71 | PPOX (0.48) | PARP1NPSR1GSK3BSTK10SLK | |
| SCHEMBL31241414 | 0.71 | CES1 (0.63) | PARP1MEN1RGS12USP2CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-52091029-A | — | — | None | — | — | JP | disclosed |
| JP-S5291029-A | NITRO SUBSTITUTED 4,5-DICHLORO NAPHTHALIC IMIDE | MITSUBISHI CHEM IND LTD | 1977-08-01 | — | — | JP | disclosed |