Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | PRKCI | P41743 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 7/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 7/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | NOS3 | P29474 | 1/20 | 0.34 |
| ▸ | NOS2 | P35228 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | USP7 | Q93009 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29211012 | 0.86 | ESR1 (0.39) | TRPA1PRKCIALDH1A1ALOX15HSD17B10 | |
| SCHEMBL23804830 | 0.86 | ESR1 (0.39) | TRPA1PRKCIALDH1A1ALOX15HSD17B10 | |
| SCHEMBL30478808 | 0.84 | PDE10A (0.45) | ALDH1A1ALOX15HSD17B10ESR1ESR2 | |
| SCHEMBL5823114 | 0.84 | BACE1 (0.40) | TRPA1PRKCIBACE1ACHEESR1 | |
| SCHEMBL2423001 | 0.84 | NOS3 (0.44) | TRPA1ALDH1A1ALOX15HSD17B10GAA | |
| SCHEMBL652985 | 0.84 | BACE1 (0.40) | TRPA1PRKCIBACE1ACHEESR1 | |
| SCHEMBL3685532 | 0.82 | CA1 (0.39) | TRPA1PRKCIALDH1A1ALOX15HSD17B10 | |
| SCHEMBL29178121 | 0.82 | ESR1 (0.37) | TRPA1PRKCIBACE1ESR1ESR2 | |
| SCHEMBL858277 | 0.81 | TRPA1 (0.48) | TRPA1ALDH1A1HSD17B10GAABACE1 | |
| SCHEMBL30026897 | 0.81 | TRPA1 (0.48) | TRPA1ALDH1A1HSD17B10GAABACE1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1534225-A1 | METHOD OF COLOURING POROUS MATERIAL | Ciba Specialty Chemicals Holding Inc. (CH) | 2005-06-01 | — | — | EP | disclosed |
| WO-2004019896-A1 | METHOD OF COLOURING POROUS MATERIAL | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2004-03-11 | — | — | WO | disclosed |