Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKB | Q96GD4 | 2/20 | 0.51 |
| ▸ | AURKA | O14965 | 1/20 | 0.51 |
| ▸ | TTR | P02766 | 2/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | SNCA | P37840 | 2/20 | 0.42 |
| ▸ | CHAT | P28329 | 1/20 | 0.42 |
| ▸ | COMT | P21964 | 1/20 | 0.40 |
| ▸ | ATIC | P31939 | 2/20 | 0.38 |
| ▸ | CDK2 | P24941 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | FABP4 | P15090 | 1/20 | 0.38 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | NR4A1 | P22736 | 2/20 | 0.37 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.36 |
| ▸ | MPL | P40238 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9813353 | 0.94 | AURKB (0.53) | AURKBAURKATTRCYP1A2SNCA | |
| SCHEMBL156515 | 0.86 | AURKB (0.66) | AURKBAURKATTRCYP1A2SNCA | |
| SCHEMBL1806701 | 0.80 | AURKA (0.44) | AURKBAURKATTRALDH1A1FABP4 | |
| SCHEMBL313371 | 0.80 | TTR (0.53) | AURKBAURKATTRCYP1A2SNCA | |
| SCHEMBL11147033 | 0.79 | AURKB (0.53) | AURKBAURKATTRCYP1A2SNCA | |
| SCHEMBL2932464 | 0.79 | AURKB (0.67) | AURKBAURKATTRCYP1A2SNCA | |
| SCHEMBL7037649 | 0.79 | AURKA (0.49) | AURKBAURKATTRCYP1A2SNCA | |
| SCHEMBL158215 | 0.79 | TTR (0.50) | AURKBAURKATTRCYP1A2SNCA | |
| SCHEMBL147102 | 0.79 | TTR (0.60) | AURKBAURKATTRCYP1A2SNCA | |
| SCHEMBL159399 | 0.78 | AURKA (0.75) | AURKBAURKATTRCYP1A2SNCA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120056931-A1 | MAGENTA COLORING MATTER, INK COMPOSITION, AND COLORED BODY | NIPPON KAYAKU KABUSHIKI KAISHA (JP) | 2012-03-08 | — | — | US | disclosed |
| US-4418015-A | Phthalocyanine reactive dyestuffs | BAYER AKTIENGESELLSCHAFT (DE) | 1983-11-29 | — | — | US | disclosed |
| EP-0075808-A2 | 3,6-Dioxo-1,2-dihydro-7H-pyrazolo(3,4-b)pyridine dyes | BAYER AG (DE) | 1983-04-06 | — | — | EP | disclosed |
| EP-0053320-A2 | Process for the preparation of phthalocyanin compounds | BAYER AG (DE) | 1982-06-09 | — | — | EP | disclosed |
| EP-0047863-A2 | Reactive phthalocyanine hyes, process for their preparation and their use in dyeing materials containing hydroxyle groups and/or nitrogen | BAYER AG (DE) | 1982-03-24 | — | — | EP | disclosed |