Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 5/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | GRM5 | P41594 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TGFBR1 | P36897 | 5/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8778658 | 0.81 | CYP1A2 (0.40) | CYP1A2RAB9AALDH1A1GRM5SMN1; SMN2 | |
| SCHEMBL8778654 | 0.79 | SMN1; SMN2 (0.52) | CYP1A2RAB9AALDH1A1GRM5SMN1; SMN2 | |
| SCHEMBL8778674 | 0.78 | CCR1 (0.50) | CYP1A2TGFBR1MAPK14 | |
| SCHEMBL8778596 | 0.78 | HPGD (0.47) | CYP1A2RAB9AALDH1A1GRM5SMN1; SMN2 | |
| SCHEMBL3786284 | 0.74 | GRM5 (0.52) | CYP1A2RAB9AGRM5SMN1; SMN2NPC1 | |
| SCHEMBL8778643 | 0.73 | ALDH1A1 (0.44) | CYP1A2ALDH1A1GRM5SMN1; SMN2KMT2A | |
| SCHEMBL8778629 | 0.73 | HTT (0.44) | CYP1A2RAB9AALDH1A1GRM5SMN1; SMN2 | |
| SCHEMBL8778663 | 0.71 | ABCG2 (0.49) | CYP1A2RAB9AALDH1A1GRM5SMN1; SMN2 | |
| SCHEMBL8775946 | 0.69 | CYP1A2 (0.44) | CYP1A2KMT2AMAPK14MEN1 | |
| SCHEMBL8775777 | 0.69 | CYP1A2 (0.41) | CYP1A2TGFBR1MAPK14NPSR1 |
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-2012069601-A1 | SUBSTITUTED QUINAZOLINES AS FUNGICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2012-05-31 | — | — | WO | disclosed |