Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 10/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 2/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5307972 | 1.00 | ALDH1A1 (0.47) | ALDH1A1HPGDHTTSMN1; SMN2CA2 | |
| SCHEMBL5307075 | 1.00 | ALDH1A1 (0.47) | ALDH1A1HPGDHTTSMN1; SMN2CA2 | |
| SCHEMBL1133830 | 0.88 | ALDH1A1 (0.50) | ALDH1A1HPGDHTTSMN1; SMN2MAPK14 | |
| SCHEMBL27969814 | 0.85 | ALDH1A1 (0.51) | ALDH1A1HPGDHTTSMN1; SMN2GLA | |
| SCHEMBL5486128 | 0.84 | ALDH1A1 (0.38) | ALDH1A1HPGDHTTSMN1; SMN2CA2 | |
| SCHEMBL10338142 | 0.81 | CYP2A6 (0.40) | ALDH1A1HPGDSMN1; SMN2CA2MAPK14 | |
| SCHEMBL28937430 | 0.80 | ALDH1A1 (0.60) | ALDH1A1HPGDHTTSMN1; SMN2GLA | |
| SCHEMBL4367638 | 0.80 | ALDH1A1 (0.60) | ALDH1A1HPGDHTTSMN1; SMN2GLA | |
| SCHEMBL1034135 | 0.80 | ALDH1A1 (0.60) | ALDH1A1HPGDHTTSMN1; SMN2GLA | |
| SCHEMBL3869457 | 0.80 | ALDH1A1 (0.45) | ALDH1A1HPGDSMN1; SMN2CA2MAPK14 |
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-1994031-A1 | USE OF ADENOSINE A1 AND/OR DUAL A1/A2B AGONISTS FOR PRODUCTION OF MEDICAMENTS FOR TREATING DISEASES | Bayer HealthCare AG (DE) | 2008-11-26 | — | — | EP | disclosed |
| WO-2007101531-A1 | USE OF ADENOSINE A1 AND/OR DUAL A1/A2B AGONISTS FOR PRODUCTION OF MEDICAMENTS FOR TREATING DISEASES | BAYER HEALTHCARE AG (DE) | 2007-09-13 | — | — | WO | disclosed |
| WO-2007017267-A2 | NOVEL COMPOUNDS | GLAXO GROUP LIMITED (GB) | 2007-02-15 | — | — | WO | disclosed |