Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.56 |
| ▸ | MEN1 | O00255 | 2/20 | 0.56 |
| ▸ | GAA | P10253 | 2/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | FAAH | O00519 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.50 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
| ▸ | GPR183 | P32249 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7426490 | 0.96 | ALDH1A1 (0.64) | ALDH1A1SMN1; SMN2KMT2AMEN1GAA | |
| SCHEMBL21426211 | 0.86 | ALDH1A1 (0.89) | ALDH1A1SMN1; SMN2KMT2AMEN1GAA | |
| Hydrochloric Acid SCHEMBL23850509 | 0.85 | ALDH1A1 (0.86) | ALDH1A1SMN1; SMN2KMT2AMEN1GAA | |
| SCHEMBL7425120 | 0.83 | SIGMAR1 (0.64) | ALDH1A1POLBSIGMAR1 | |
| SCHEMBL15668030 | 0.83 | ALDH1A1 (0.96) | ALDH1A1SMN1; SMN2KMT2AMEN1GAA | |
| SCHEMBL30259080 | 0.83 | ALDH1A1 (0.96) | ALDH1A1SMN1; SMN2KMT2AMEN1GAA | |
| SCHEMBL7427068 | 0.83 | SIGMAR1 (0.69) | ALDH1A1SMN1; SMN2KMT2AMEN1GAA | |
| SCHEMBL16226986 | 0.83 | ALDH1A1 (0.82) | ALDH1A1SMN1; SMN2KMT2AMEN1GAA | |
| SCHEMBL7423301 | 0.82 | ALDH1A1 (0.50) | ALDH1A1KMT2AMEN1FAAHKDM4E | |
| SCHEMBL16225922 | 0.81 | ALDH1A1 (0.74) | ALDH1A1SMN1; SMN2KMT2AMEN1GAA |
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-1997044334-A2 | NOVEL PIPERAZINE OR HOMOPIPERAZINE DERIVATIVES, PHARMACEUTICAL COMPOSITIONS CONTAINING THE SAME AND A PROCESS FOR THEIR PREPARATION | EGIS Gyógyszergyár Rt. (HU) | 1997-11-27 | — | — | WO | disclosed |