Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | DRD2 | P14416 | 2/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.47 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.45 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.40 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.38 |
| ▸ | ICMT | O60725 | 1/20 | 0.36 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | AURKA | O14965 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.36 |
| ▸ | PAK4 | O96013 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21661970 | 0.85 | KDM4E (0.54) | KDM4EALDH1A1DRD2SLC6A4MTNR1A | |
| SCHEMBL18541949 | 0.80 | BRD4 (0.49) | KDM4EALDH1A1 | |
| SCHEMBL7828711 | 0.80 | KDM4E (0.51) | KDM4EALDH1A1DRD2SLC6A4MTNR1A | |
| SCHEMBL18508879 | 0.78 | KDM4E (0.58) | KDM4EALDH1A1DRD2SLC6A4KCNH2 | |
| SCHEMBL15944077 | 0.77 | KDM4E (0.50) | KDM4EALDH1A1DRD2SLC6A4MEN1 | |
| SCHEMBL12534047 | 0.76 | IDO1 (0.60) | KDM4EALDH1A1MEN1NPC1POLB | |
| SCHEMBL28346754 | 0.76 | IDO1 (0.60) | KDM4EALDH1A1MEN1NPC1POLB | |
| SCHEMBL623472 | 0.75 | HTR2C (0.51) | KDM4EALDH1A1DRD2SLC6A4MEN1 | |
| SCHEMBL30520734 | 0.75 | HTR2C (0.51) | KDM4EALDH1A1DRD2SLC6A4MEN1 | |
| SCHEMBL27489308 | 0.75 | KDM4E (0.55) | KDM4EALDH1A1DRD2SLC6A4MTNR1A |
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 |
|---|---|---|---|---|---|---|---|
| US-6828325-B2 | A benzoxazolopiperazine derivative useful for treating Parkinson's diseases, schizophrenia, anxiety and depression | SOLVAY PHARMACEUTICALS B.V. (CH) | 2004-12-07 | — | — | US | disclosed |