Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 1/20 | 0.49 |
| ▸ | MMP2 | P08253 | 5/20 | 0.44 |
| ▸ | ADAMTS4 | O75173 | 2/20 | 0.44 |
| ▸ | MMP1 | P03956 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 1/20 | 0.44 |
| ▸ | MMP14 | P50281 | 1/20 | 0.44 |
| ▸ | MEP1B | Q16820 | 1/20 | 0.44 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.44 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL7701622 | 0.88 | L3MBTL1 (0.44) | L3MBTL1ALDH1A1GAAHPGDHTT | |
| SCHEMBL7675029 | 0.86 | L3MBTL1 (0.44) | CASP1MMP2ADAMTS4MMP1MMP13 | |
| SCHEMBL7704469 | 0.83 | KCNA5 (0.52) | CASP1MMP2ADAMTS4MMP1KCNA5 | |
| SCHEMBL7694147 | 0.82 | ACE (0.46) | MMP1L3MBTL1ALDH1A1GAAHPGD | |
| SCHEMBL7694696 | 0.82 | KDM4E (0.47) | L3MBTL1ALDH1A1GAAHPGDHTT | |
| SCHEMBL7689922 | 0.78 | CAPN1 (0.57) | CASP1MMP2KCNA5MMP9 | |
| SCHEMBL7701518 | 0.77 | CA2 (0.44) | CASP1KCNA5CA2 | |
| SCHEMBL7705654 | 0.76 | CAPN1 (0.46) | CASP1KCNA5ALDH1A1CA2MMP9 | |
| SCHEMBL7701291 | 0.76 | GFER (0.41) | CASP1MMP2ADAMTS4MMP1MMP13 | |
| SCHEMBL7698802 | 0.75 | CAPN1 (0.67) | CASP1KCNA5CA2 |
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-6436925-B1 | BETTER ABLE TO CROSS MEMBRANES; INHIBITORS OF CYSTEINE PROTEASES LIKE CALPAIN I AND II AND CATHEPSIN B AND L, CAN THUS BE USED TO CONTROL DISEASES ASSOCIATED WITH AN ELEVATED ACTIVITY OF CALPAIN ENZYMES OR CATHEPSIN ENZYMES | ABBOTT LABORATORIES | 2002-08-20 | — | — | US | disclosed |