Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UGT2B7 | P16662 | 1/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.37 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.36 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL30292897 | 0.85 | AKR1C3 (0.52) | TDP1CYP1A2TSHR | |
| SCHEMBL2835326 | 0.80 | ALDH1A1 (0.50) | MEN1KMT2AALDH1A1TDP1CYP2D6 | |
| SCHEMBL7699172 | 0.80 | ALDH1A1 (0.50) | MEN1KMT2AALDH1A1TDP1CYP2D6 | |
| SCHEMBL4186797 | 0.79 | UGT2B7 (0.52) | UGT2B7GLAMMP9MEN1KMT2A | |
| SCHEMBL6753377 | 0.79 | UGT2B7 (0.47) | UGT2B7MEN1KMT2AATMAOC3 | |
| SCHEMBL10397026 | 0.78 | ALDH1A1 (0.59) | MEN1KMT2AATMALDH1A1TDP1 | |
| SCHEMBL9863162 | 0.78 | ALDH1A1 (0.59) | MEN1KMT2AATMALDH1A1TDP1 | |
| SCHEMBL9862906 | 0.78 | ALDH1A1 (0.59) | MEN1KMT2AATMALDH1A1TDP1 | |
| SCHEMBL10120468 | 0.78 | UGT2B7 (0.55) | UGT2B7GLAMMP9MEN1KMT2A | |
| SCHEMBL7514315 | 0.78 | UGT2B7 (0.55) | UGT2B7GLAMMP9MEN1KMT2A |
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-2003104167-A2 | CYANOHYDRIN ETHERS AND ESTERS AS HIGH-SENSITIVITY ENZYME SUBSTRATES | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2003-12-18 | — | — | WO | disclosed |