Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRD5A1 | P18405 | 3/20 | 0.40 |
| ▸ | NOTUM | Q6P988 | 5/20 | 0.37 |
| ▸ | AADAT | Q8N5Z0 | 2/20 | 0.37 |
| ▸ | GOT1 | P17174 | 1/20 | 0.37 |
| ▸ | KYAT1 | Q16773 | 1/20 | 0.37 |
| ▸ | KYAT3 | Q6YP21 | 1/20 | 0.37 |
| ▸ | CRBN | Q96SW2 | 2/20 | 0.36 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL2898175 | 0.73 | RAB9A (0.36) | CRBNDDB1ALDH1A1KDM4EGAA | |
| SCHEMBL19335725 | 0.69 | SRD5A1 (0.37) | SRD5A1NOTUMAADATGOT1KYAT1 | |
| SCHEMBL30404647 | 0.66 | NOTUM (0.53) | NOTUMAADATGOT1KYAT1KYAT3 | |
| SCHEMBL5178322 | 0.66 | SRD5A1 (0.41) | SRD5A1ALDH1A1KDM4EDRD2DRD4 | |
| SCHEMBL1366432 | 0.65 | DDB1 (0.48) | NOTUMAADATGOT1KYAT1KYAT3 | |
| SCHEMBL5132769 | 0.65 | DDB1 (0.48) | NOTUMAADATGOT1KYAT1KYAT3 | |
| SCHEMBL11829199 | 0.62 | CRBN (0.52) | CRBNDDB1ALDH1A1KDM4EGAA | |
| SCHEMBL11819839 | 0.62 | ALDH1A1 (0.49) | ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL3467602 | 0.61 | NOTUM (0.39) | SRD5A1NOTUMAADATGOT1KYAT1 | |
| SCHEMBL13790854 | 0.60 | SRD5A1 (0.45) | SRD5A1NOTUMALDH1A1ADRA1A |
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-2880036-A1 | PIPERAZINO[1,2-A]INDOL-1-ONES AND [1,4]DIAZEPINO[1,2-A]INDOL-1-ONE | F. Hoffmann-La Roche AG (CH) | 2015-06-10 | — | — | EP | disclosed |
| WO-2014023674-A1 | PIPERAZINO[1,2-A]INDOL-1-ONES AND [1,4]DIAZEPINO[1,2-A]INDOL-1-ONE | F. HOFFMANN-LA ROCHE AG (CH) | 2014-02-13 | — | — | WO | disclosed |