Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | CYP17A1 | P05093 | 3/20 | 0.56 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.56 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.45 |
| ▸ | SPHK2 | Q9NRA0 | 1/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | F2 | P00734 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8544266 | 0.89 | HPGD (0.54) | ALDH1A1P2RX7SMN1; SMN2HSD11B1F2 | |
| SCHEMBL8549705 | 0.85 | PKM (0.54) | ALDH1A1SMN1; SMN2MAPTF2PKM | |
| SCHEMBL8549491 | 0.83 | KMT2A (0.47) | ALDH1A1CYP17A1CYP19A1SMN1; SMN2HSD11B1 | |
| SCHEMBL8549484 | 0.83 | KMT2A (0.47) | ALDH1A1CYP17A1CYP19A1SMN1; SMN2HSD11B1 | |
| SCHEMBL8543196 | 0.83 | HSD11B1 (0.62) | ALDH1A1P2RX7SMN1; SMN2HSD11B1PKM | |
| SCHEMBL8543051 | 0.77 | RAB9A (0.56) | ALDH1A1SMN1; SMN2HPGDCYP2C19 | |
| SCHEMBL8546687 | 0.75 | MAPK1 (0.57) | ALDH1A1SMN1; SMN2HSD11B1F2CYP3A4 | |
| SCHEMBL8543192 | 0.75 | HSD11B1 (0.54) | ALDH1A1P2RX7SMN1; SMN2HSD11B1EPHX1 | |
| SCHEMBL8548918 | 0.75 | HSD11B1 (0.54) | ALDH1A1P2RX7SMN1; SMN2HSD11B1EPHX1 | |
| SCHEMBL8544264 | 0.74 | HSD11B1 (0.46) | ALDH1A1P2RX7HSD11B1EPHX1MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0564924-B1 | 2-Oxoethyl derivatives as immunosuppressants | BAYER AG (US) | 1998-09-09 | — | — | EP | claimed |
| EP-0564924-B1 | 2-Oxoethyl derivatives as immunosuppressants | BAYER AG (US) | 1998-09-09 | — | — | EP | disclosed |
| EP-0564924-A2 | 2-Oxoethyl derivatives as immunosuppressants | Bayer Corporation (US) | 1993-10-13 | — | — | EP | disclosed |