Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MC4R | P32245 | 3/20 | 0.37 |
| ▸ | MC3R | P41968 | 3/20 | 0.37 |
| ▸ | MC1R | Q01726 | 3/20 | 0.37 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.37 |
| ▸ | ITGB7 | P26010 | 2/20 | 0.37 |
| ▸ | ELANE | P08246 | 1/20 | 0.35 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.35 |
| ▸ | GPR34 | Q9UPC5 | 1/20 | 0.35 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 2/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.33 |
| ▸ | ITGB1 | P05556 | 2/20 | 0.33 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.33 |
| ▸ | ITGAV | P06756 | 1/20 | 0.33 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.33 |
| ▸ | XIAP | P98170 | 1/20 | 0.33 |
| ▸ | FPR1 | P21462 | 2/20 | 0.32 |
| ▸ | FPR2 | P25090 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4044539 | 0.94 | ITGA4 (0.36) | ITGA4ITGB7ELANEP2RX7CTSK | |
| SCHEMBL4051785 | 0.93 | ITGA4 (0.39) | ITGA4ITGB7ELANECTSKITGB3 | |
| SCHEMBL6211121 | 0.90 | CTSK (0.43) | MC4RMC3RMC1RITGA4ITGB7 | |
| SCHEMBL4046932 | 0.89 | GPR132 (0.35) | ITGA4ITGB7ELANECTSKITGB3 | |
| SCHEMBL4050328 | 0.89 | SCN9A (0.39) | MC4RMC3RMC1RITGA4ITGB7 | |
| SCHEMBL4045311 | 0.88 | CTSK (0.43) | ELANECTSK | |
| SCHEMBL4040539 | 0.88 | MC4R (0.41) | MC4RMC3RMC1RITGA4ITGB7 | |
| SCHEMBL4043139 | 0.88 | ELANE (0.37) | ITGA4ITGB7ELANECTSK | |
| SCHEMBL4041436 | 0.84 | ALDH1A1 (0.39) | MC4RMC3RMC1RITGA4ITGB7 | |
| SCHEMBL4052754 | 0.84 | CTSK (0.42) | MC4RMC3RMC1RP2RX7GPR34 |
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-1546150-B1 | PYRROLE DERIVATIVES AS INHIBITORS OF CYTEINE PROTEASES | AMURA THERAPEUTICS LTD (GB) | 2009-03-04 | — | — | EP | claimed |