Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | FKBP1A | P62942 | 2/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.46 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | MMP8 | P22894 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.41 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.41 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8133901 | 0.88 | SMYD3 (0.54) | SMYD3NPSR1MEN1KMT2ASLC6A2 | |
| SCHEMBL8133713 | 0.88 | SMYD3 (0.54) | SMYD3MEN1KMT2ASLC6A2SLC6A4 | |
| SCHEMBL6543961 | 0.87 | SMYD3 (0.45) | SMYD3SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL8134541 | 0.86 | SMYD3 (0.53) | SMYD3NPSR1MEN1KMT2ASLC6A2 | |
| SCHEMBL8132870 | 0.84 | SMYD3 (0.52) | SMYD3SLC6A2SLC6A4SLC6A3ALDH1A1 | |
| SCHEMBL8707282 | 0.83 | CYP2D6 (0.50) | SMN1; SMN2FKBP1AMEN1KMT2AALDH1A1 | |
| SCHEMBL7918355 | 0.79 | NR3C2 (0.51) | SMYD3SMN1; SMN2MAPTMEN1KMT2A | |
| SCHEMBL373284 | 0.77 | SMN1; SMN2 (0.74) | SMN1; SMN2NPSR1MEN1KMT2ASLC6A2 | |
| SCHEMBL8709388 | 0.77 | HTT (0.46) | SMN1; SMN2FKBP1ANPSR1MAPTMEN1 | |
| SCHEMBL1919144 | 0.77 | SLC6A2 (0.56) | SMYD3MEN1KMT2ASLC6A2SLC6A4 |
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-1998018762-A1 | NEW DERIVATIVES OF DIVERSELY SUBSTITUTED CYCLICAL AMIDE SELECTIVE ANTAGONISTS OF THE HUMAN RECEPTOR NK3, PROCESS FOR OBTAINING THEM, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SANOFI (FR) | 1998-05-07 | — | — | WO | disclosed |