Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.50 |
| ▸ | HTR2A | P28223 | 2/20 | 0.47 |
| ▸ | HTR2C | P28335 | 2/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | AHR | P35869 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MMP1 | P03956 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1200588 | 0.85 | CA1 (0.53) | HTTALDH1A1LMNAMAPTGAA | |
| SCHEMBL13112963 | 0.83 | TDP1 (0.52) | HTTHTR2AHTR2CKCNH2ALDH1A1 | |
| SCHEMBL22206134 | 0.78 | CA1 (0.54) | ALDH1A1LMNAGAACA12CA1 | |
| SCHEMBL28230363 | 0.78 | CA1 (0.54) | ALDH1A1LMNAGAACA12CA1 | |
| SCHEMBL7825197 | 0.77 | HTT (0.59) | HTTALDH1A1LMNAMAPTGAA | |
| SCHEMBL7825189 | 0.77 | HTT (0.59) | HTTALDH1A1LMNAMAPTGAA | |
| SCHEMBL16232170 | 0.77 | MMP2 (0.50) | HTR2AHTR2CKCNH2ALDH1A1CA12 | |
| SCHEMBL8013573 | 0.77 | MMP2 (0.55) | CA12CA1CA2CA9MMP1 | |
| SCHEMBL6470795 | 0.75 | SLC1A3 (0.49) | ALDH1A1LMNAMAPTCA12CA1 | |
| SCHEMBL8959071 | 0.74 | CA2 (0.54) | ALDH1A1LMNACA12CA1CA2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-1177821-C | Matrix metalloprotease inhibitors | - | 2004-12-01 | — | — | CN | disclosed |
| CN-1160045-A | Matrix metalloprotease inhibitors | HOFFMANN LA ROCHE (CH) | 1997-09-24 | — | — | CN | disclosed |