Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5AP | P20292 | 2/20 | 0.39 |
| ▸ | FEN1 | P39748 | 2/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | BCR | P11274 | 1/20 | 0.38 |
| ▸ | SLC2A1 | P11166 | 2/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | BTK | Q06187 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GLA | P06280 | 1/20 | 0.35 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.34 |
| ▸ | EPAS1 | Q99814 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12680869 | 0.90 | ALOX5AP (0.37) | ALOX5APFEN1SCN9AABL1BCR | |
| SCHEMBL10270755 | 0.89 | SCN9A (0.40) | ALOX5APFEN1SCN9AABL1BCR | |
| SCHEMBL3612472 | 0.83 | ABL1 (0.39) | ALOX5APFEN1SCN9AABL1BCR | |
| SCHEMBL10270320 | 0.82 | CALCA (0.35) | ALDH1A1KDM4ENPC1RAB9A | |
| SCHEMBL10270318 | 0.81 | ALDH1A1 (0.36) | ADORA1ALDH1A1KDM4E | |
| SCHEMBL16784812 | 0.80 | ACVR1 (0.39) | SCN9AALDH1A1GAAKDM4EGLA | |
| SCHEMBL16784798 | 0.79 | TBK1 (0.37) | ADORA1ALDH1A1KDM4EGLANPC1 | |
| SCHEMBL3608208 | 0.77 | SLC2A1 (0.47) | ALOX5APFEN1SCN9ASLC2A1TRPV1 | |
| SCHEMBL3606754 | 0.77 | SCN9A (0.46) | ALOX5APFEN1SCN9ASLC2A1TRPV1 | |
| SCHEMBL10270558 | 0.74 | KLK7 (0.37) | ALDH1A1KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2137188-B1 | SUBSTITUTED IMIDAZOPYRIMIDINES AND TRIAZOLOPYRIMIDINES | Bayer Pharma AG (DE) | 2012-06-06 | — | — | EP | disclosed |
| WO-2008113469-A2 | SUBSTITUTED IMIDAZOPYRIMIDINES AND TRIAZOLOPYRIMIDINES | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2008-09-25 | — | — | WO | disclosed |