Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K14 | Q99558 | 1/20 | 0.45 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.31 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.31 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.31 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 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 | |
|---|---|---|---|---|
| SCHEMBL2172848 | 0.83 | MAP3K14 (0.40) | MAP3K14ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL29457617 | 0.78 | MAP3K14 (0.43) | MAP3K14 | |
| SCHEMBL24345590 | 0.78 | MAP3K14 (0.43) | MAP3K14 | |
| SCHEMBL16396399 | 0.77 | MAP3K14 (0.49) | MAP3K14ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL24345592 | 0.76 | MAP3K14 (0.42) | MAP3K14 | |
| SCHEMBL29457640 | 0.76 | MAP3K14 (0.42) | MAP3K14 | |
| SCHEMBL26915926 | 0.75 | MAP3K14 (0.46) | MAP3K14ADRA2A | |
| SCHEMBL29457653 | 0.74 | ADRA2A (0.30) | ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL25166053 | 0.73 | MAP3K14 (0.49) | MAP3K14ADRA2AADRA2BADRA2CADRA1A | |
| SCHEMBL6026797 | 0.72 | MAP3K14 (0.51) | MAP3K14ADRA2AADRA2BADRA2CADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3981773-A1 | DYNAMIC KINETIC RESOLUTION OF ALCOHOLS BY ENANTIOSELECTIVE SILYLATION | Technische Universität Berlin (DE) | 2022-04-13 | — | — | EP | disclosed |