Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | HBB | P68871 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | AHR | P35869 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL28776208 | 0.98 | ALDH1A1 (0.45) | ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2 | |
| SCHEMBL5478906 | 0.94 | ALDH1A1 (0.40) | ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2 | |
| SCHEMBL11126907 | 0.94 | ALDH1A1 (0.40) | ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2 | |
| SCHEMBL937286 | 0.92 | ALDH1A1 (0.41) | ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2 | |
| SCHEMBL30918302 | 0.92 | ALDH1A1 (0.41) | ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2 | |
| SCHEMBL28191024 | 0.89 | ALDH1A1 (0.37) | ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2 | |
| SCHEMBL9928987 | 0.88 | CYP1B1 (0.40) | ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2 | |
| SCHEMBL5438141 | 0.86 | CYP1B1 (0.41) | ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2 | |
| Phenazine SCHEMBL11222513 | 0.86 | NQO2 (0.45) | ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2 | |
| Biphenyl SCHEMBL22806928 | 0.85 | ALDH1A1 (0.37) | ALDH1A1HSD17B10CYP1B1HIF1ACYP1A2 |
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-20060160981-A1 | Phenolic polymer nanotube and producing the same | JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) | 2006-07-20 | — | — | US | disclosed |