Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MMP2 | P08253 | 9/20 | 0.50 |
| ▸ | MMP13 | P45452 | 9/20 | 0.50 |
| ▸ | MMP1 | P03956 | 8/20 | 0.50 |
| ▸ | MMP9 | P14780 | 8/20 | 0.50 |
| ▸ | MMP8 | P22894 | 7/20 | 0.50 |
| ▸ | CA1 | P00915 | 5/20 | 0.50 |
| ▸ | CA2 | P00918 | 5/20 | 0.50 |
| ▸ | MMP3 | P08254 | 3/20 | 0.40 |
| ▸ | MMP12 | P39900 | 2/20 | 0.40 |
| ▸ | MMP14 | P50281 | 2/20 | 0.40 |
| ▸ | MMP16 | P51512 | 2/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.38 |
| ▸ | ADAMTS4 | O75173 | 2/20 | 0.37 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.36 |
| ▸ | ITGAV | P06756 | 1/20 | 0.35 |
| ▸ | MMP7 | P09237 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL15896282 | 1.00 | MMP2 (0.50) | MMP2MMP13MMP1MMP9MMP8 | |
| SCHEMBL15882782 | 0.81 | CA1 (0.50) | MMP2MMP13MMP1MMP9MMP8 | |
| SCHEMBL29707965 | 0.81 | CA1 (0.50) | MMP2MMP13MMP1MMP9MMP8 | |
| Cxl-1020 SCHEMBL1767680 | 0.78 | CA1 (0.55) | MMP2MMP13MMP1MMP9MMP8 | |
| Hydrochloric Acid SCHEMBL28825246 | 0.76 | MYC (0.43) | MMP2MMP13MMP1MMP9MMP8 | |
| SCHEMBL14519930 | 0.75 | HSD11B1 (0.39) | MMP2MMP13MMP1MMP9MMP8 | |
| SCHEMBL10699531 | 0.75 | CA1 (0.57) | MMP2MMP13MMP1MMP9MMP8 | |
| SCHEMBL15882505 | 0.74 | CA1 (0.52) | MMP2MMP13MMP1MMP9MMP8 | |
| SCHEMBL29707981 | 0.74 | CA1 (0.52) | MMP2MMP13MMP1MMP9MMP8 | |
| SCHEMBL4636106 | 0.74 | CA1 (0.55) | MMP2MMP13MMP1MMP9MMP8 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110179777-B | Pharmaceutical compositions comprising nitroxyl donors | 卡尔迪奥克斯尔制药公司 | 2022-07-15 | — | — | CN | disclosed |