Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.47 |
| ▸ | TSPO | P30536 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | IDE | P14735 | 1/20 | 0.43 |
| ▸ | HRH2 | P25021 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CREBBP | Q92793 | 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 | |
|---|---|---|---|---|
| SCHEMBL4859493 | 0.85 | ALDH1A1 (0.50) | ALDH1A1KMT2ATSPOMEN1MAPT | |
| SCHEMBL5204952 | 0.83 | HRH2 (0.55) | ALDH1A1HRH2 | |
| SCHEMBL5202530 | 0.81 | ALDH1A1 (0.42) | ALDH1A1KMT2AMAPTCREBBP | |
| SCHEMBL4852959 | 0.75 | SMN1; SMN2 (0.53) | ALDH1A1KMT2AHRH2CREBBP | |
| SCHEMBL5801705 | 0.73 | RORC (0.47) | ALDH1A1KMT2AMEN1MAPTIDE | |
| SCHEMBL5202270 | 0.72 | MAPT (0.43) | ALDH1A1KMT2AMEN1MAPTUSP2 | |
| SCHEMBL5205820 | 0.72 | HRH2 (0.42) | KMT2AMAPTHRH2 | |
| SCHEMBL4854486 | 0.72 | ALDH1A1 (0.46) | ALDH1A1KMT2AMEN1HRH2CYP3A4 | |
| SCHEMBL4860552 | 0.72 | HRH2 (0.46) | ALDH1A1KMT2AMAPTHRH2 | |
| SCHEMBL4851493 | 0.72 | MEN1 (0.45) | KMT2AMEN1HRH2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1654253-B1 | SUBSTITUTED 3-PYRROLIDIN-INDOLE DERIVATIVES | GRUENENTHAL GMBH (DE) | 2007-01-03 | — | — | EP | claimed |
| EP-1654253-B1 | SUBSTITUTED 3-PYRROLIDIN-INDOLE DERIVATIVES | GRUENENTHAL GMBH (DE) | 2007-01-03 | — | — | EP | disclosed |