Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 1/20 | 0.47 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.43 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.41 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.41 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.41 |
| ▸ | HDAC5 | Q9UQL6 | 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 | |
|---|---|---|---|---|
| SCHEMBL5184545 | 0.83 | GRM5 (0.47) | RAB9A | |
| SCHEMBL1105523 | 0.74 | S1PR2 (0.46) | FFAR1ALDH1A1MAPTHSP90AA1HTT | |
| SCHEMBL404588 | 0.74 | S1PR2 (0.46) | FFAR1ALDH1A1MAPTHSP90AA1HTT | |
| SCHEMBL404589 | 0.74 | S1PR2 (0.46) | FFAR1ALDH1A1MAPTHSP90AA1HTT | |
| SCHEMBL404504 | 0.71 | FFAR1 (0.44) | FFAR1ALDH1A1MAPTHSP90AA1HTT | |
| SCHEMBL399936 | 0.71 | FFAR1 (0.44) | FFAR1ALDH1A1MAPTHSP90AA1HTT | |
| SCHEMBL440373 | 0.71 | HTT (0.45) | ALDH1A1MAPTHSP90AA1HTTNPSR1 | |
| SCHEMBL5184336 | 0.70 | RAB9A (0.51) | ALDH1A1HDAC1HDAC3HDAC4HDAC7 | |
| SCHEMBL28728423 | 0.69 | TSHR (0.67) | FFAR1ALDH1A1MAPTHSP90AA1HTT | |
| SCHEMBL404493 | 0.68 | BCHE (0.38) | ALDH1A1S1PR2HDAC1HDAC8HDAC6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1618087-A4 | ANTIBACTERIAL AGENTS | NOVARTIS VACCINES & DIAGNOSTIC (US) | 2007-01-31 | — | — | EP | disclosed |
| EP-1618087-A2 | ANTIBACTERIAL AGENTS | CHIRON CORPORATION (US) | 2006-01-25 | — | — | EP | disclosed |
| WO-2004062601-A2 | ANTIBACTERIAL AGENTS | CHIRON CORPORATION (US) | 2004-07-29 | — | — | WO | disclosed |