Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 5/20 | 0.47 |
| ▸ | CA1 | P00915 | 5/20 | 0.47 |
| ▸ | CA2 | P00918 | 5/20 | 0.47 |
| ▸ | CA9 | Q16790 | 5/20 | 0.47 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.41 |
| ▸ | FPR3 | P25089 | 2/20 | 0.40 |
| ▸ | FPR2 | P25090 | 2/20 | 0.40 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.40 |
| ▸ | MAN2B1 | O00754 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5030182 | 0.89 | TDP1 (0.51) | TDP1KMT2AMAOAMAOBMEN1 | |
| SCHEMBL5030185 | 0.89 | TDP1 (0.51) | TDP1KMT2AMAOAMAOBMEN1 | |
| SCHEMBL4077144 | 0.89 | TDP1 (0.59) | TDP1KMT2AMAOAMAOBMEN1 | |
| SCHEMBL25122814 | 0.87 | TDP1 (0.54) | TDP1KMT2AMAOAMAOBMEN1 | |
| SCHEMBL19594077 | 0.85 | TDP1 (0.56) | TDP1KMT2AMAOAMAOBMEN1 | |
| SCHEMBL25123076 | 0.85 | TDP1 (0.56) | TDP1KMT2AMAOAMAOBMEN1 | |
| SCHEMBL7816256 | 0.83 | TDP1 (0.61) | TDP1KMT2AMAOAMAOBMEN1 | |
| SCHEMBL13739185 | 0.83 | TDP1 (0.57) | TDP1KMT2AMAOAMAOBMEN1 | |
| SCHEMBL4072834 | 0.83 | EPHX1 (0.57) | TDP1KMT2AMAOAMAOBMEN1 | |
| SCHEMBL12648114 | 0.82 | EPHX1 (0.55) | TDP1KMT2AMAOAMAOBMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1546108-A1 | 1,4-SUBSTITUTED CYCLOHEXANE DERIVATIVES | UNIVERSITE DE MONTREAL (CA) | 2005-06-29 | — | — | EP | disclosed |
| WO-2004022541-A1 | 1,4-SUBSTITUTED CYCLOHEXANE DERIVATIVES | UNIVERSITE DE MONTREAL (CA) | 2004-03-18 | — | — | WO | disclosed |