Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.36 |
| ▸ | HTR7 | P34969 | 2/20 | 0.35 |
| ▸ | HTR2B | P41595 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA4 | P22748 | 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 | |
|---|---|---|---|---|
| SCHEMBL16230462 | 0.89 | HTR7 (0.47) | TDP1CYP1A2CYP2A6ALDH1A1ELANE | |
| SCHEMBL13825602 | 0.77 | MAOA (0.39) | TDP1ALOX15TP53CYP3A4THRB | |
| SCHEMBL27980189 | 0.76 | ELANE (0.44) | SMN1; SMN2ALDH1A1ELANEHTR7HTR2B | |
| SCHEMBL15435550 | 0.75 | CYP1A2 (0.33) | CYP1A2CYP2A6ALDH1A1ELANEHSD17B10 | |
| SCHEMBL23222447 | 0.75 | DYRK1A (0.39) | TDP1ALOX15TP53CYP3A4THRB | |
| SCHEMBL29174122 | 0.75 | MAOB (0.38) | TDP1ALOX15TP53CYP3A4THRB | |
| SCHEMBL8752734 | 0.75 | DYRK1A (0.56) | TDP1TP53MAOAMAOBCYP1A2 | |
| SCHEMBL5684539 | 0.75 | TDP1 (0.40) | TDP1ALOX15TP53CYP3A4THRB | |
| SCHEMBL12378277 | 0.75 | MAOA (0.38) | TDP1ALOX15TP53CYP3A4THRB | |
| Hydrochloric Acid SCHEMBL5985822 | 0.73 | TDP1 (0.38) | TDP1ALOX15TP53CYP3A4THRB |
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 |
|---|---|---|---|---|---|---|---|
| EP-2687304-A1 | METAL COMPLEX COMPOSITIONS AND MIXTURE THEREOF | Sumitomo Chemical Company Limited (JP) | 2014-01-22 | — | — | EP | disclosed |