Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 7/20 | 0.36 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | THPO | P40225 | 1/20 | 0.33 |
| ▸ | BLM | P54132 | 1/20 | 0.33 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8932244 | 0.92 | KMT2A (0.48) | KMT2AADORA2AADORA1TGFBR1PTGS2 | |
| SCHEMBL8932271 | 0.90 | KMT2A (0.39) | KMT2AADORA2AADORA1TGFBR1HDAC1 | |
| SCHEMBL8932311 | 0.86 | KMT2A (0.46) | KMT2AADORA2AADORA1TGFBR1PTGS2 | |
| SCHEMBL8932302 | 0.86 | KMT2A (0.44) | KMT2AADORA2AADORA1TGFBR1PTGS2 | |
| SCHEMBL8932297 | 0.84 | KMT2A (0.48) | KMT2AADORA2AADORA1TGFBR1PTGS2 | |
| SCHEMBL8932284 | 0.84 | TGFBR1 (0.41) | KMT2ATGFBR1PTGS2PTGS1ALDH1A1 | |
| SCHEMBL5547806 | 0.83 | KMT2A (0.50) | KMT2AADORA2AADORA1TGFBR1PTGS2 | |
| SCHEMBL8932255 | 0.83 | KMT2A (0.47) | KMT2AADORA2AADORA1TGFBR1PTGS2 | |
| SCHEMBL8932283 | 0.83 | KMT2A (0.47) | KMT2AADORA2AADORA1TGFBR1PTGS2 | |
| SCHEMBL8932303 | 0.81 | KMT2A (0.45) | KMT2AADORA2AADORA1TGFBR1PTGS2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5536701-A | 3-pyrazolyloxypyridazines, herbicidal compositions and uses thereof | MONSANTO COMPANY (US) | 1996-07-16 | — | — | US | claimed |
| US-5536701-A | 3-pyrazolyloxypyridazines, herbicidal compositions and uses thereof | MONSANTO COMPANY (US) | 1996-07-16 | — | — | US | disclosed |