Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.44 |
| ▸ | ALOX5AP | P20292 | 5/20 | 0.43 |
| ▸ | MAOB | P27338 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | AGXT | P21549 | 1/20 | 0.39 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
| ▸ | RXRA | P19793 | 1/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 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 | |
|---|---|---|---|---|
| SCHEMBL24050046 | 0.81 | TAAR1 (0.44) | TAAR1MAOBGRIN1GRIN2B | |
| SCHEMBL13562421 | 0.79 | ALDH1A1 (0.46) | TAAR1ALDH1A1MEN1KMT2A | |
| SCHEMBL27777189 | 0.76 | MRGPRX4 (0.51) | — | |
| SCHEMBL1631126 | 0.75 | MAOB (0.54) | TAAR1MAOBALDH1A1MAPK1MEN1 | |
| SCHEMBL18622091 | 0.75 | KEAP1 (0.50) | TAAR1ALDH1A1MEN1KMT2AIDO1 | |
| SCHEMBL14573460 | 0.74 | CCR1 (0.52) | ALDH1A1 | |
| SCHEMBL27827710 | 0.74 | KEAP1 (0.43) | ALOX5APALDH1A1KMT2A | |
| SCHEMBL21241344 | 0.73 | ALDH1A1 (0.49) | ALDH1A1 | |
| SCHEMBL24671918 | 0.73 | UHRF1 (0.44) | RXRAGRIN1GRIN2B | |
| Toluene SCHEMBL27965026 | 0.73 | MRGPRX4 (0.48) | KMT2A |
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-2019149260-A1 | PYRIDAZINOL COMPOUND, DERIVATIVE THEREOF, PREPARATION METHOD THEREFOR, HERBICIDAL COMPOSITION AND USE THEREOF | 青岛清原化合物有限公司 | 2019-08-08 | — | — | WO | disclosed |