Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 4/20 | 0.48 |
| ▸ | PPARA | Q07869 | 4/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | CTRC | Q99895 | 1/20 | 0.40 |
| ▸ | FPR2 | P25090 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 2/20 | 0.38 |
| ▸ | CNR1 | P21554 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
| ▸ | MMP7 | P09237 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
| ▸ | MME | P08473 | 1/20 | 0.37 |
| ▸ | GRN | P28799 | 1/20 | 0.36 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5516590 | 1.00 | PPARG (0.48) | PPARGPPARAKMT2APOLBMEN1 | |
| SCHEMBL5516586 | 1.00 | PPARG (0.48) | PPARGPPARAKMT2APOLBMEN1 | |
| SCHEMBL5512484 | 0.89 | CHRM2 (0.43) | KMT2AMEN1FPR2CTSKCNR1 | |
| SCHEMBL5512480 | 0.89 | CHRM2 (0.43) | KMT2AMEN1FPR2CTSKCNR1 | |
| SCHEMBL5510848 | 0.86 | FPR2 (0.39) | FPR2CTSKLMNAMMP1MMP2 | |
| SCHEMBL5520701 | 0.84 | FPR2 (0.42) | KMT2AMEN1FPR2CTSKMMP1 | |
| SCHEMBL5520704 | 0.84 | FPR2 (0.42) | KMT2AMEN1FPR2CTSKMMP1 | |
| SCHEMBL5516079 | 0.84 | CYP19A1 (0.38) | KMT2AFPR2CTSKLMNAMMP1 | |
| SCHEMBL5512488 | 0.84 | PPARG (0.55) | PPARGPPARAKMT2AALDH1A1LMNA | |
| SCHEMBL5517853 | 0.83 | CTSK (0.56) | CTSK |
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-1537074-A1 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | MERCK FROSST CANADA INC. (CA) | 2005-06-08 | — | — | EP | disclosed |
| WO-2004022526-A1 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | MERCK FROSST CANADA & CO. (CA) | 2004-03-18 | — | — | WO | disclosed |