Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.39 |
| ▸ | NR1H3 | Q13133 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CASP3 | P42574 | 2/20 | 0.37 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2092874 | 0.89 | NR1H4 (0.42) | CYP1A2NPC1RAB9AKMT2AL3MBTL1 | |
| SCHEMBL28653098 | 0.69 | CYP1A2 (0.47) | CYP1A2NPC1RAB9AHTTKMT2A | |
| SCHEMBL435137 | 0.69 | CYP1A2 (0.47) | CYP1A2NPC1RAB9AHTTKMT2A | |
| SCHEMBL354121 | 0.68 | BRD4 (0.42) | NPC1RAB9AKMT2AL3MBTL1GAA | |
| SCHEMBL314833 | 0.68 | BRD4 (0.47) | NPC1RAB9AKMT2AL3MBTL1GAA | |
| SCHEMBL28637707 | 0.68 | NR1H4 (0.78) | CYP1A2NPC1RAB9AHTTKMT2A | |
| SCHEMBL28651531 | 0.68 | NR1H4 (0.78) | CYP1A2NPC1RAB9AHTTKMT2A | |
| SCHEMBL183912 | 0.67 | CYP1A2 (1.00) | CYP1A2NPC1RAB9AHTTKMT2A | |
| SCHEMBL4454036 | 0.67 | CYP1A2 (1.00) | CYP1A2NPC1RAB9AHTTKMT2A | |
| SCHEMBL25440250 | 0.66 | NPC1 (0.70) | CYP1A2NPC1RAB9AHTTKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-2595985-A1 | ISOXAZOLE, ISOTHIAZOLE, FURANE AND THIOPHENE COMPOUNDS AS MICROBICIDES | Syngenta Participations AG (CH) | 2013-05-29 | — | — | EP | disclosed |
| WO-2012010567-A1 | ISOXAZOLE, ISOTHIAZOLE, FURANE AND THIOPHENE COMPOUNDS AS MICROBICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2012-01-26 | — | — | WO | disclosed |