Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | CTSD | P07339 | 1/20 | 0.40 |
| ▸ | MMP1 | P03956 | 1/20 | 0.39 |
| ▸ | MMP7 | P09237 | 1/20 | 0.39 |
| ▸ | MMP12 | P39900 | 1/20 | 0.39 |
| ▸ | ECE1 | P42892 | 1/20 | 0.39 |
| ▸ | MMP13 | P45452 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.35 |
| ▸ | NSD2 | O96028 | 1/20 | 0.35 |
| ▸ | TTR | P02766 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.34 |
| ▸ | CASP2 | P42575 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL15972918 | 0.89 | MMP1 (0.43) | MMP1MMP7MMP12ECE1MMP13 | |
| SCHEMBL1161221 | 0.83 | MMP1 (0.37) | MMP1MMP7MMP12ECE1MMP13 | |
| SCHEMBL21667707 | 0.79 | NR1H4 (0.38) | CTSDMMP1MMP7MMP12ECE1 | |
| SCHEMBL19528973 | 0.79 | MAPT (0.49) | ALDH1A1 | |
| SCHEMBL18954254 | 0.78 | EPHX2 (0.56) | ALDH1A1 | |
| SCHEMBL14103319 | 0.77 | KDM1A (0.36) | MMP1MMP7MMP12ECE1MMP13 | |
| SCHEMBL16181058 | 0.77 | NR1H4 (0.43) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL18162794 | 0.76 | CA1 (0.40) | MMP1MMP7MMP12ECE1MMP13 | |
| SCHEMBL14103116 | 0.76 | MGAM (0.38) | MMP1MMP7MMP12ECE1MMP13 | |
| SCHEMBL10092606 | 0.76 | SCN9A (0.33) | MMP1MMP7MMP12ECE1MMP13 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011032277-A1 | QUINAZOLINONE DERIVATIVES AS VIRAL POLYMERASE INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2011-03-24 | — | — | WO | disclosed |