Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.38 |
| ▸ | MGAM | O43451 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | SI | P14410 | 1/20 | 0.31 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.30 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.30 |
| ▸ | CES2 | O00748 | 1/20 | 0.30 |
| ▸ | CES1 | P23141 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Isopropyl Alcohol SCHEMBL16094105 | 0.93 | TSHR (0.37) | ALDH1A1THRBTSHR | |
| SCHEMBL15329266 | 0.84 | ALDH1A1 (0.46) | ALDH1A1THRBTSHRMGAMGAA | |
| SCHEMBL727178 | 0.78 | ALDH1A1 (0.48) | ALDH1A1THRBTSHRMGAMGAA | |
| SCHEMBL8641857 | 0.76 | TSHR (0.42) | ALDH1A1THRBTSHRHDAC3HDAC1 | |
| SCHEMBL27722645 | 0.76 | ALDH1A1 (0.44) | ALDH1A1THRBTSHRMGAMGAA | |
| SCHEMBL6292365 | 0.74 | MGAM (0.40) | ALDH1A1THRBTSHRMGAMGAA | |
| SCHEMBL3844764 | 0.74 | TSHR (0.55) | ALDH1A1TSHRCES2CES1 | |
| SCHEMBL7761909 | 0.74 | TSHR (0.55) | ALDH1A1TSHRCES2CES1 | |
| SCHEMBL27686811 | 0.73 | TSHR (0.44) | ALDH1A1THRBTSHR | |
| SCHEMBL4138390 | 0.72 | ALDH1A1 (0.41) | ALDH1A1TSHRMGAMGAASI |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010144348-A2 | REDUCTION OF ANTIBIOTIC ACTIVITY OR CONCENTRATION IN BIOLOGICAL SAMPLES USING MOLECULARLY IMPRINTED POLYMERS | BECTON, DICKINSON AND COMPANY (US) | 2010-12-16 | — | — | WO | disclosed |