Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CD44 | P16070 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 3/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.33 |
| ▸ | PTPRC | P08575 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | MAOB | P27338 | 1/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | KEAP1 | Q14145 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7545678 | 0.87 | ALDH1A1 (0.54) | ALDH1A1L3MBTL1CD44CYP3A4HSD17B10 | |
| SCHEMBL6228512 | 0.84 | ALDH1A1 (0.62) | ALDH1A1L3MBTL1CYP3A4HSD17B10TSHR | |
| SCHEMBL6228503 | 0.83 | ALDH1A1 (0.46) | ALDH1A1L3MBTL1CD44CYP3A4HSD17B10 | |
| SCHEMBL560128 | 0.83 | ALDH1A1 (0.56) | ALDH1A1L3MBTL1CD44CYP3A4HSD17B10 | |
| SCHEMBL31554259 | 0.82 | ALDH1A1 (0.35) | ALDH1A1L3MBTL1CD44CYP3A4HSD17B10 | |
| SCHEMBL28345869 | 0.82 | ALDH1A1 (0.35) | ALDH1A1L3MBTL1CD44CYP3A4HSD17B10 | |
| Hydrochloric Acid SCHEMBL4521251 | 0.80 | ALDH1A1 (0.53) | ALDH1A1L3MBTL1CD44CYP3A4HSD17B10 | |
| Methane SCHEMBL22720568 | 0.80 | ALDH1A1 (0.53) | ALDH1A1L3MBTL1CD44CYP3A4HSD17B10 | |
| SCHEMBL28448451 | 0.78 | ALDH1A1 (0.58) | ALDH1A1L3MBTL1CD44CYP3A4HSD17B10 | |
| SCHEMBL2224609 | 0.75 | ALDH1A1 (0.72) | ALDH1A1L3MBTL1CD44CYP3A4HSD17B10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2003119172-A | NEW COMPOUND HAVING SKELETON OF TETRAKISAMINOPHENYL(DI) PHENYLENE DIAMINE AND METHOD OF USING THE SAME | NIPPON KAYAKU CO LTD | 2003-04-23 | — | — | JP | disclosed |
| JP-2002212066-A | NEW PHOTOCHEMOTHERAPEUTIC AGENT | NIPPON KAYAKU CO LTD | 2002-07-31 | — | — | JP | disclosed |
| JP-2002173474-A | NEW COMPOUND HAVING TETRAKISAMINOPHENYL (DI) PHENYLENEDIAMINE SKELETON | NIPPON KAYAKU CO LTD | 2002-06-21 | — | — | JP | disclosed |