Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | KDM1A | O60341 | 2/20 | 0.34 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.33 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | BACE1 | P56817 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6166242 | 1.00 | HTT (0.42) | HTTKDM1ASLC18A3MAP1LC3BSIGMAR1 | |
| SCHEMBL6166684 | 0.85 | MAOB (0.33) | KDM4EKMT2A | |
| SCHEMBL6166773 | 0.76 | HTT (0.52) | HTT | |
| SCHEMBL6164169 | 0.75 | HTT (0.48) | HTTKDM4EMEN1KMT2A | |
| SCHEMBL6168258 | 0.69 | HTT (0.65) | HTT | |
| SCHEMBL6166822 | 0.68 | HTT (0.44) | HTTKDM4EMEN1KMT2A | |
| SCHEMBL6164522 | 0.67 | TACR1 (0.33) | KDM1ABACE1 | |
| SCHEMBL6167339 | 0.67 | HTT (0.45) | HTTKDM4EMEN1KMT2A | |
| SCHEMBL6166383 | 0.66 | KDM1A (0.34) | KDM1ABACE1 | |
| SCHEMBL6166381 | 0.66 | KDM1A (0.34) | KDM1ABACE1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1177185-B1 | 4, 5, 6, 7-TETRAHYDROINDAZOLE DERIVATIVES AS ANTITUMOR AGENTS | PHARMACIA ITALIA SPA (IT) | 2005-04-20 | — | — | EP | disclosed |