Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.55 |
| ▸ | MMP2 | P08253 | 2/20 | 0.47 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.45 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | PARL | Q9H300 | 1/20 | 0.41 |
| ▸ | FAAH | O00519 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2965640 | 1.00 | ACHE (0.55) | ACHEMMP2EPHX2AKR1C3ALDH1A1 | |
| SCHEMBL2961151 | 0.96 | ACHE (0.52) | ACHEMMP2EPHX2AKR1C3FAAH | |
| SCHEMBL8319432 | 0.96 | ACHE (0.52) | ACHEMMP2EPHX2AKR1C3FAAH | |
| SCHEMBL13201349 | 0.94 | ACHE (0.49) | ACHEMMP2EPHX2AKR1C3FAAH | |
| SCHEMBL13201340 | 0.87 | MMP2 (0.53) | ACHEMMP2EPHX2AKR1C3MMP9 | |
| SCHEMBL13201328 | 0.84 | CA9 (0.52) | ACHEMMP2EPHX2MMP9 | |
| SCHEMBL2964063 | 0.84 | PSEN1 (0.43) | ACHEMMP2EPHX2ALDH1A1LMNA | |
| SCHEMBL8320723 | 0.84 | PSEN1 (0.43) | ACHEMMP2EPHX2ALDH1A1LMNA | |
| SCHEMBL8327403 | 0.84 | TDP1 (0.41) | ACHEALDH1A1LMNAHTT | |
| SCHEMBL8320725 | 0.84 | EPHX2 (0.42) | ACHEEPHX2AKR1C3ALDH1A1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| US-7772270-B2 | Imino acid derivatives as inhibitors of matrix metalloproteinases | SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) | 2010-08-10 | — | — | US | disclosed |