Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABBR2 | O75899 | 1/20 | 0.37 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | NAMPT | P43490 | 1/20 | 0.33 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.33 |
| ▸ | BACE1 | P56817 | 2/20 | 0.32 |
| ▸ | AKT1 | P31749 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27877353 | 0.81 | GABBR2 (0.37) | GABBR2GABBR1HPGDKMT2ANPC1 | |
| SCHEMBL27894256 | 0.80 | CYP3A4 (0.42) | GABBR2GABBR1HPGDNAMPTALDH1A1 | |
| SCHEMBL28801425 | 0.78 | GABBR2 (0.31) | GABBR2GABBR1 | |
| SCHEMBL27877354 | 0.73 | RECQL (0.44) | GABBR2GABBR1KMT2ANPC1RAB9A | |
| SCHEMBL28757676 | 0.71 | KCNH3 (0.42) | P2RX7NAMPTNLRP3KMT2ARAB9A | |
| SCHEMBL27893992 | 0.71 | GABBR2 (0.47) | GABBR2GABBR1HPGDKMT2ARAB9A | |
| SCHEMBL2045567 | 0.70 | GSK3B (0.50) | HPGDKMT2ANPC1RAB9APOLB | |
| SCHEMBL27680282 | 0.70 | GABBR2 (0.46) | GABBR2GABBR1HPGDKMT2ANPC1 | |
| SCHEMBL7815206 | 0.67 | PTPRA (0.44) | CHRM4KMT2APOLBMAPTMEN1 | |
| SCHEMBL7815207 | 0.67 | PTPRA (0.44) | CHRM4KMT2APOLBMAPTMEN1 |
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-102762551-A | Thienylpyri (mi) dinylpyrazoles and their use for controlling phytopathogenic fungi | BAYER CROPSCIENCE AG | 2012-10-31 | — | — | CN | disclosed |