Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | P2RY12 | Q9H244 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 5/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | AKT1 | P31749 | 1/20 | 0.35 |
| ▸ | AKT2 | P31751 | 1/20 | 0.35 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL7052594 | 0.87 | MEN1 (0.53) | ALDH1A1KDM4EP2RY12MEN1MAPT | |
| SCHEMBL7050290 | 0.86 | KDM4E (0.56) | ALDH1A1KDM4EP2RY12MEN1MAPT | |
| SCHEMBL7049798 | 0.85 | MEN1 (0.47) | ALDH1A1KDM4EP2RY12MEN1PDGFRB | |
| SCHEMBL5849791 | 0.78 | P2RY12 (0.42) | ALDH1A1KDM4EP2RY12MEN1PDGFRB | |
| SCHEMBL7052962 | 0.77 | KMT2A (0.40) | ALDH1A1MEN1MAPTHTTNPSR1 | |
| SCHEMBL7053767 | 0.74 | P2RY12 (0.38) | ALDH1A1P2RY12MEN1KMT2A | |
| SCHEMBL7052654 | 0.74 | P2RY12 (0.43) | P2RY12MEN1 | |
| SCHEMBL7054311 | 0.73 | HTT (0.41) | ALDH1A1KDM4EP2RY12MEN1MAPT | |
| SCHEMBL7052685 | 0.72 | SMN1; SMN2 (0.53) | ALDH1A1KDM4EP2RY12MEN1MAPT | |
| SCHEMBL7050933 | 0.70 | KDM4E (0.43) | ALDH1A1KDM4EP2RY12MEN1ACHE |
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-2003022214-A2 | PIPERAZINE AND HOMOPIPERAZINE COMPOUNDS | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2003-03-20 | — | — | WO | disclosed |