Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | RECQL | P46063 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CRHBP | P24387 | 2/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | CSNK2A1 | P68400 | 2/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL17364639 | 0.84 | CYP2C8 (0.38) | RECQLCYP2C8PDE4BCSNK2A1HDAC1 | |
| SCHEMBL19904403 | 0.80 | ALDH1A1 (0.36) | ALDH1A1MAPTRECQLMEN1KMT2A | |
| SCHEMBL24045454 | 0.78 | HRH1 (0.47) | ALDH1A1RECQLSMN1; SMN2 | |
| SCHEMBL21122862 | 0.78 | ABCB1 (0.46) | ALDH1A1RECQL | |
| SCHEMBL19904683 | 0.78 | SIGMAR1 (0.38) | ALDH1A1MAPTRECQLMEN1KMT2A | |
| SCHEMBL18634973 | 0.76 | HDAC1 (0.44) | MEN1KMT2AHPGDHDAC1HDAC2 | |
| SCHEMBL19904660 | 0.74 | HRH3 (0.46) | MAPTCRHBPCRHR2SMN1; SMN2PDE4B | |
| SCHEMBL8037047 | 0.71 | SKP2 (0.40) | CYP2C8GAASMN1; SMN2SKP2 | |
| SCHEMBL23239959 | 0.71 | CYP2C8 (0.47) | CYP2C8MAPK1 | |
| SCHEMBL21934681 | 0.70 | SKP2 (0.36) | HTTCYP2C8SMN1; SMN2HPGDBACE1 |
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-2632269-B1 | CYCLIC AMINE SUBSTITUTED OXAZOLIDINONES AS CETP INHIBITORS | MERCK SHARP & DOHME (US) | 2017-03-15 | — | — | EP | disclosed |