Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 2/20 | 0.42 |
| ▸ | IDO1 | P14902 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | PTGES | O14684 | 1/20 | 0.38 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.38 |
| ▸ | MAP2K1 | Q02750 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | PLK4 | O00444 | 1/20 | 0.38 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 1/20 | 0.38 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.38 |
| ▸ | LTK | P29376 | 1/20 | 0.38 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.38 |
| ▸ | FLT3 | P36888 | 1/20 | 0.38 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.38 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL12006859 | 0.70 | ALDH1A1 (0.59) | IDO1ALDH1A1L3MBTL1CYP1A2CYP3A4 | |
| SCHEMBL8747067 | 0.69 | GAA (0.47) | TRPA1ALDH1A1L3MBTL1MAP2K1CYP1A2 | |
| SCHEMBL11329015 | 0.69 | PDE7A (0.45) | IDO1ALDH1A1L3MBTL1CYP1A2CYP3A4 | |
| SCHEMBL174458 | 0.68 | — | — | |
| SCHEMBL11629253 | 0.66 | PTGES (0.44) | IDO1ALDH1A1PTGESCYP1A2CYP2C9 | |
| SCHEMBL5755006 | 0.66 | ITK (0.47) | TRPA1IDO1ALDH1A1CYP1A2CYP2C9 | |
| SCHEMBL28837181 | 0.66 | ADORA2A (0.43) | IDO1ALDH1A1L3MBTL1CYP1A2CYP3A4 | |
| SCHEMBL695032 | 0.65 | LMNA (0.53) | ALDH1A1L3MBTL1CYP1A2PIM1CDK5 | |
| SCHEMBL71324 | 0.65 | — | — | |
| SCHEMBL29565104 | 0.65 | — | — |
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-0053678-A1 | 5-Amino-1-phenyl-4-cyano pyrazoles, herbicides containing them, process for their preparation and their use as herbicides | BASF Aktiengesellschaft (DE) | 1982-06-16 | — | — | EP | claimed |
| EP-0053678-A1 | 5-Amino-1-phenyl-4-cyano pyrazoles, herbicides containing them, process for their preparation and their use as herbicides | BASF Aktiengesellschaft (DE) | 1982-06-16 | — | — | EP | disclosed |