Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | ALOX15B | O15296 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | CEL | P19835 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL433498 | 0.83 | CEL (0.33) | OPRL1NPC1RAB9ASMN1; SMN2ALOX15B | |
| SCHEMBL436492 | 0.81 | ABCB1 (0.40) | ABCB1OPRL1 | |
| SCHEMBL435217 | 0.75 | OPRL1 (0.36) | ABCB1OPRL1CEL | |
| SCHEMBL457959 | 0.72 | PTGS1 (0.31) | OPRL1PTGS1PTGS2 | |
| SCHEMBL6447974 | 0.71 | ABCB1 (0.36) | ABCB1PTGS1PTGS2 | |
| SCHEMBL4689694 | 0.70 | OPRL1 (0.61) | ABCB1OPRL1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL29659605 | 0.69 | ABCB1 (0.44) | ABCB1OPRL1NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL20606723 | 0.68 | OPRL1 (0.60) | ABCB1OPRL1SMN1; SMN2ALDH1A1MAPT | |
| SCHEMBL10568941 | 0.68 | CEL (0.35) | CELPTGS2 | |
| SCHEMBL9137720 | 0.68 | — | — |
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 4 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 |
| EP-2595984-A1 | MICROBICIDES | Syngenta Participations AG (CH) | 2013-05-29 | — | — | EP | disclosed |
| WO-2012010568-A1 | MICROBICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2012-01-26 | — | — | WO | disclosed |
| WO-2012010567-A1 | ISOXAZOLE, ISOTHIAZOLE, FURANE AND THIOPHENE COMPOUNDS AS MICROBICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2012-01-26 | — | — | WO | disclosed |