Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | MMP1 | P03956 | 1/20 | 0.31 |
| ▸ | MMP2 | P08253 | 1/20 | 0.31 |
| ▸ | MMP9 | P14780 | 1/20 | 0.31 |
| ▸ | MMP8 | P22894 | 1/20 | 0.31 |
| ▸ | CA9 | Q16790 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MME | P08473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7129808 | 0.89 | MEN1 (0.34) | ALDH1A1TSHRCA12CA1CA2 | |
| SCHEMBL29531381 | 0.87 | SMN1; SMN2 (0.39) | ALDH1A1HSD17B10TSHRCA12CA1 | |
| SCHEMBL7136164 | 0.87 | SMN1; SMN2 (0.39) | ALDH1A1HSD17B10TSHRCA12CA1 | |
| SCHEMBL29531261 | 0.87 | SMN1; SMN2 (0.39) | ALDH1A1HSD17B10TSHRCA12CA1 | |
| SCHEMBL27721767 | 0.72 | — | — | |
| SCHEMBL10947530 | 0.71 | TSHR (0.43) | ALDH1A1THRBCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL8747892 | 0.71 | L3MBTL1 (0.41) | ALDH1A1THRBCYP2C9CYP2C19HSD17B10 | |
| SCHEMBL24723658 | 0.70 | CHRNB2 (0.34) | ALDH1A1CYP2C19HSD17B10TSHRGAA | |
| SCHEMBL15314139 | 0.70 | CHRNB2 (0.34) | ALDH1A1CYP2C19HSD17B10TSHRGAA | |
| SCHEMBL31462139 | 0.70 | CHRNB2 (0.37) | ALDH1A1HSD17B10TSHR |
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-1140797-A1 | PRODUCTION OF ACRYLIC MONOMERS | Ciba Specialty Chemicals Water Treatments Limited (GB) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000041996-A1 | PRODUCTION OF ACRYLIC MONOMERS | CIBA SPECIALTY CHEMICALS WATER TREATMENTS LIMITED (GB) | 2000-07-20 | — | — | WO | disclosed |