Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 2/20 | 0.47 |
| ▸ | NQO1 | P15559 | 1/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HPGDS | O60760 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA4 | P22748 | 1/20 | 0.34 |
| ▸ | CA6 | P23280 | 1/20 | 0.34 |
| ▸ | CA5A | P35218 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.34 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.34 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.33 |
| ▸ | DDX3X | O00571 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL22344835 | 0.79 | ALDH1A1 (0.39) | CYP2C9ADORA2AALDH1A1HSD17B10TSHR | |
| SCHEMBL9558885 | 0.79 | TTR (0.64) | TTRNQO1AURKAAURKBGAA | |
| SCHEMBL2296085 | 0.72 | TTR (0.60) | TTRAURKAAURKBGAACYP2C9 | |
| SCHEMBL11125884 | 0.72 | ALDH1A1 (0.38) | TTRNQO1AURKAAURKBGAA | |
| SCHEMBL11125354 | 0.72 | NPC1 (0.37) | TTRNQO1AURKAAURKBGAA | |
| SCHEMBL11715352 | 0.72 | CTRB1 (0.35) | GAAHPGDSCYP2C9NR4A1ALDH1A1 | |
| SCHEMBL30011676 | 0.71 | TTR (0.55) | TTRNQO1AURKAAURKBGAA | |
| SCHEMBL27561452 | 0.70 | TTR (0.53) | TTRNQO1AURKAAURKBGAA | |
| SCHEMBL2294438 | 0.70 | ADORA2A (0.61) | TTRNQO1ADORA2AALDH1A1TDP1 | |
| Ammonia Solution, Strong SCHEMBL9680150 | 0.70 | TTR (0.62) | TTRAURKAAURKBGAACYP2C9 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0187520-B1 | WATER-SOLUBLE DYE | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1990-01-24 | — | — | EP | disclosed |
| US-4777248-A | Water-soluble non-reactive triazinyl mono-azo dye for ink jet printing | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1988-10-11 | — | — | US | disclosed |
| US-4726844-A | LIGHTFASTNESS | CANON KABUSHIKI KAISHA (JP) | 1988-02-23 | — | — | US | disclosed |
| EP-0187520-A2 | Water-soluble dye | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1986-07-16 | — | — | EP | disclosed |