Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | TSHR | P16473 | 3/20 | 0.36 |
| ▸ | CA12 | O43570 | 3/20 | 0.36 |
| ▸ | CA2 | P00918 | 3/20 | 0.36 |
| ▸ | CA3 | P07451 | 3/20 | 0.36 |
| ▸ | CA4 | P22748 | 3/20 | 0.36 |
| ▸ | CA6 | P23280 | 3/20 | 0.36 |
| ▸ | CA5A | P35218 | 3/20 | 0.36 |
| ▸ | CA7 | P43166 | 3/20 | 0.36 |
| ▸ | CA9 | Q16790 | 3/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 3/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29132828 | 0.92 | TDP1 (0.52) | TDP1MAPTCHRM2CYP2C9CYP2C19 | |
| Trimethylammonium SCHEMBL27932178 | 0.86 | CHRM2 (0.46) | TDP1CHRM2NFKB1ALDH1A1TSHR | |
| Dimethylaminoethanol SCHEMBL3381335 | 0.84 | MAPT (0.63) | TDP1MAPTCHRM2CYP2C9CYP2C19 | |
| Trimethylammonium SCHEMBL27490946 | 0.83 | CHRM2 (0.43) | TDP1CHRM2NFKB1ALDH1A1TSHR | |
| Monoethanolamine SCHEMBL29132870 | 0.83 | MAPT (0.59) | TDP1MAPTCHRM2CYP2C9CYP2C19 | |
| SCHEMBL10939450 | 0.83 | CHRM2 (0.63) | TDP1CHRM2CYP2C9CYP2C19NFKB1 | |
| SCHEMBL26493978 | 0.82 | CHRM2 (0.71) | TDP1MAPTCHRM2NFKB1ALDH1A1 | |
| Dimethylaminoethanol SCHEMBL10935556 | 0.80 | MAPT (0.57) | TDP1MAPTCHRM2CYP2C9CYP2C19 | |
| SCHEMBL26494013 | 0.80 | CHRM2 (0.76) | TDP1CHRM2ALDH1A1TSHRCA12 | |
| SCHEMBL26493997 | 0.80 | CHRM2 (0.76) | TDP1CHRM2ALDH1A1TSHRCA12 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117282256-A | Aqueous mixed amine liquid-liquid phase absorbent for capturing carbon dioxide | 四川大学 | 2023-12-26 | — | — | CN | disclosed |