Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.31 |
| ▸ | CNR1 | P21554 | 2/20 | 0.31 |
| ▸ | CNR2 | P34972 | 2/20 | 0.31 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.30 |
| ▸ | CETP | P11597 | 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 | |
|---|---|---|---|---|
| SCHEMBL8590105 | 1.00 | MAPK1 (0.33) | MAPK1TDP1EPHX2HDAC1HDAC2 | |
| SCHEMBL28601887 | 0.82 | CETP (0.38) | CETP | |
| SCHEMBL17134050 | 0.76 | TDP1 (0.37) | MAPK1TDP1EPHX2 | |
| SCHEMBL27635408 | 0.75 | ALDH1A1 (0.35) | MAPK1TDP1EPHX2 | |
| SCHEMBL9482342 | 0.73 | MAPT (0.50) | — | |
| SCHEMBL9482339 | 0.73 | MAPT (0.50) | — | |
| SCHEMBL27606091 | 0.73 | TDP1 (0.35) | MAPK1TDP1EPHX2 | |
| SCHEMBL11383989 | 0.72 | MAPK1 (0.42) | MAPK1TDP1EPHX2 | |
| SCHEMBL10785918 | 0.72 | KCNA3 (0.43) | MAPK1TDP1HDAC1HDAC2 | |
| SCHEMBL835424 | 0.72 | MAOB (0.38) | HDAC1HDAC2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5716841-A | Process for the resolution of ethyl 4,4,4-trifluoro-3(R)-hydroxybutanoate using lipase from candida | SYNTHELABO (FR) | 1998-02-10 | — | — | US | disclosed |