Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 7/20 | 0.56 |
| ▸ | PIK3CD | O00329 | 4/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | GPR39 | O43194 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.38 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6445919 | 0.86 | HIF1A (0.51) | HIF1AHTTLMNAMAPTTSHR | |
| SCHEMBL6444939 | 0.82 | APP (0.53) | HIF1APIK3CDKDM4EGPR39ALDH1A1 | |
| SCHEMBL6445492 | 0.81 | ADORA1 (0.54) | HIF1AHTTLMNAMAPTTSHR | |
| SCHEMBL5041821 | 0.80 | ADORA2A (0.50) | HIF1AHTTLMNAMAPTTSHR | |
| SCHEMBL6441227 | 0.77 | HIF1A (0.39) | HIF1AHTTLMNAMAPTTSHR | |
| SCHEMBL6446516 | 0.76 | METAP1 (0.48) | HIF1APIK3CDHTTMAPTKDM4E | |
| SCHEMBL6446164 | 0.75 | ADORA2A (0.43) | HIF1AHTTLMNAMAPTTSHR | |
| SCHEMBL6444686 | 0.72 | RAB9A (0.42) | PIK3CDMAPTKDM4ENPC1ALDH1A1 | |
| SCHEMBL6443545 | 0.70 | ADORA1 (0.63) | APP | |
| SCHEMBL6441970 | 0.70 | CYP1A2 (0.57) | HIF1APIK3CDHTTLMNAMAPT |
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-1261327-B1 | ADENOSINE RECEPTOR MODULATORS | HOFFMANN LA ROCHE (CH) | 2005-04-27 | — | — | EP | disclosed |
| EP-1261327-A2 | ADENOSINE RECEPTOR MODULATORS | F.HOFFMANN-LA ROCHE AG (CH) | 2002-12-04 | — | — | EP | disclosed |
| WO-2001062233-A2 | ADENOSINE RECEPTOR MODULATORS | F. HOFFMANN LA ROCHE AG (CH) | 2001-08-30 | — | — | WO | disclosed |