Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP1 | P03956 | 6/20 | 0.34 |
| ▸ | MMP3 | P08254 | 6/20 | 0.34 |
| ▸ | MMP7 | P09237 | 5/20 | 0.34 |
| ▸ | MMP2 | P08253 | 5/20 | 0.34 |
| ▸ | MMP9 | P14780 | 4/20 | 0.34 |
| ▸ | MMP8 | P22894 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | FAAH | O00519 | 2/20 | 0.32 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | MMP13 | P45452 | 4/20 | 0.31 |
| ▸ | BCAT1 | P54687 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4047338 | 0.90 | TACR2 (0.33) | MMP1MMP3MMP7MMP2MMP9 | |
| SCHEMBL4045182 | 0.89 | KCNQ1 (0.37) | MMP1MMP3MMP7MMP9KDM4E | |
| SCHEMBL4050955 | 0.86 | CTSK (0.37) | FAAHTRPV1 | |
| SCHEMBL4050428 | 0.83 | HPGD (0.33) | KDM4EMEN1CYP1A2RECQLKMT2A | |
| SCHEMBL4040665 | 0.82 | HPGD (0.38) | MMP1MMP3MMP2MMP9MMP8 | |
| SCHEMBL4046100 | 0.82 | KLK7 (0.35) | MMP1MMP3MMP7MMP9KDM4E | |
| SCHEMBL4049248 | 0.82 | CTSV (0.31) | KDM4ERECQLBCAT1ALDH1A1GAA | |
| SCHEMBL4042354 | 0.82 | TAS1R3 (0.37) | BCAT1ALDH1A1GAALMNAL3MBTL1 | |
| SCHEMBL4043466 | 0.82 | CHRNB2 (0.40) | KDM4EKMT2AALDH1A1GAATACR2 | |
| SCHEMBL4043383 | 0.81 | TAS1R3 (0.35) | BCAT1ALDH1A1GAAL3MBTL1KCNQ1 |
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 |