Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MC4R | P32245 | 1/20 | 0.38 |
| ▸ | MC3R | P41968 | 1/20 | 0.38 |
| ▸ | MC1R | Q01726 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 6/20 | 0.35 |
| ▸ | CCR1 | P32246 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | MMP1 | P03956 | 1/20 | 0.34 |
| ▸ | MMP3 | P08254 | 1/20 | 0.34 |
| ▸ | MMP9 | P14780 | 1/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | KLK7 | P49862 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | TACR1 | P25103 | 1/20 | 0.32 |
| ▸ | GPR132 | Q9UNW8 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL4044339 | 0.94 | ALDH1A1 (0.37) | MC4RMC3RMC1RCTSKMMP1 | |
| SCHEMBL4043183 | 0.93 | CTSK (0.43) | MC4RMC3RMC1RCYP3A4CYP2C9 | |
| SCHEMBL4043596 | 0.92 | ELANE (0.38) | MC4RMC3RMC1RCYP3A4CYP2C9 | |
| SCHEMBL4044730 | 0.90 | LMNA (0.39) | CTSKCCR1ROCK2MMP1MMP3 | |
| SCHEMBL4043124 | 0.90 | POLB (0.34) | CTSKELANESMN1; SMN2RXFP1KDM4E | |
| SCHEMBL4045687 | 0.89 | MC4R (0.34) | MC4RMC3RMC1RCTSKCCR1 | |
| SCHEMBL4042570 | 0.89 | CTSK (0.34) | MC4RMC3RMC1RCTSKMMP1 | |
| SCHEMBL4046940 | 0.88 | KDM4E (0.35) | MC4RMC3RMC1RCTSKMMP1 | |
| SCHEMBL4045553 | 0.88 | CTSK (0.34) | MC4RMC3RMC1RCTSKELANE | |
| SCHEMBL4047844 | 0.88 | SMYD3 (0.35) | MC4RMC3RMC1RCTSKTACR1 |
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 |