Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.52 |
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
| ▸ | CA7 | P43166 | 2/20 | 0.50 |
| ▸ | CA9 | Q16790 | 2/20 | 0.50 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.50 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.46 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.46 |
| ▸ | MMP2 | P08253 | 6/20 | 0.46 |
| ▸ | MMP9 | P14780 | 4/20 | 0.46 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.46 |
| ▸ | CTSL | P07711 | 2/20 | 0.45 |
| ▸ | CTSS | P25774 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL9819677 | 0.85 | POLB (0.55) | POLBCA12CA7CA9CA14 | |
| SCHEMBL20335114 | 0.85 | POLB (0.55) | POLBCA12CA7CA9CA14 | |
| SCHEMBL6435869 | 0.84 | POLB (0.69) | POLBCA12CA7CA9CA14 | |
| SCHEMBL6435872 | 0.84 | POLB (0.69) | POLBCA12CA7CA9CA14 | |
| SCHEMBL20334978 | 0.84 | POLB (0.69) | POLBCA12CA7CA9CA14 | |
| Formaldehyde SCHEMBL19474730 | 0.83 | CTSL (0.64) | POLBCA7CA2MMP2MMP9 | |
| SCHEMBL698062 | 0.82 | MMP2 (0.63) | POLBITGB3ITGA2BMMP2MMP9 | |
| SCHEMBL698061 | 0.82 | MMP2 (0.63) | POLBITGB3ITGA2BMMP2MMP9 | |
| Benzene SCHEMBL28198278 | 0.82 | MMP2 (0.63) | POLBITGB3ITGA2BMMP2MMP9 | |
| SCHEMBL6436714 | 0.82 | MMP2 (0.63) | POLBITGB3ITGA2BMMP2MMP9 |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1163466-C | Substituted oxobutanoic acid derivatives as matrix metalloproteinase inhibitors | — | 2004-08-25 | — | — | CN | disclosed |
| CN-1139570-C | Inhibition of matrix metalloproteases by acetylene contg. compounds | 拜尔公司 | 2004-02-25 | — | — | CN | disclosed |
| CN-1124255-C | Inhibition of matrix metalloproteases by substituted phenethyl compounds | BAYER AG (US) | 2003-10-15 | — | — | CN | disclosed |
| CN-1119313-C | Inhibition of matrix metalloproteinases by 2- (omega-aroylalkyl) -4-diaryl-4-oxobutanoic acid | BAYER AG (US) | 2003-08-27 | — | — | CN | disclosed |
| CN-1100748-C | Inhibition of matrix metalloproteinases by 2-substituted-4- (4-substituted phenyl) -4-oxobutanoic acid | BAYER AG (US) | 2003-02-05 | — | — | CN | disclosed |
| CN-1234791-A | Inhibition of matrix metalloproteases by 2-('omega'-aroylalkyl)-4-biaryl-oxobutyric acids | BAYER AG (US) | 1999-11-10 | — | — | CN | disclosed |
| CN-1225621-A | Inhibition of matrix metalloproteinases by 2-substituted-4- (4-substituted phenyl) -4-oxobutanoic acid | BAYER AG (US) | 1999-08-11 | — | — | CN | disclosed |
| CN-1225620-A | Substituted 4-arylbutanoic acid derivatives as matrix metalloproteinase inhibitors | BAYER AG (US) | 1999-08-11 | — | — | CN | disclosed |
| CN-1225624-A | Inhibition of matrix metalloproteases by substituted phenethyl compounds | BAYER AG (US) | 1999-08-11 | — | — | CN | disclosed |
| CN-1225622-A | Substituted oxobutyric acids as matrix metalloprotease inhibitor | BAYER AG (US) | 1999-08-11 | — | — | CN | disclosed |
| CN-1225623-A | Inhibition of matrix metalloproteases by acetylene contg. compounds | BAYER AG (US) | 1999-08-11 | — | — | CN | disclosed |