Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.61 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.45 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.45 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.45 |
| ▸ | GABBR2 | O75899 | 3/20 | 0.44 |
| ▸ | GABBR1 | Q9UBS5 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL2788979 | 0.98 | BRD4 (0.59) | BRD4ADRB2CYP2C9MEN1CYP2D6 | |
| SCHEMBL14222773 | 0.82 | BRD4 (0.47) | BRD4ADRB2CYP2C9MEN1CYP2D6 | |
| SCHEMBL951315 | 0.82 | ADRB2 (0.48) | BRD4ADRB2CYP2C9MEN1CYP2D6 | |
| SCHEMBL2896976 | 0.82 | CYP2C9 (0.55) | BRD4ADRB2CYP2C9MEN1CYP2D6 | |
| SCHEMBL14152516 | 0.82 | ADRB2 (0.48) | BRD4ADRB2CYP2C9MEN1CYP2D6 | |
| SCHEMBL390594 | 0.82 | CYP2C9 (0.55) | BRD4ADRB2CYP2C9MEN1CYP2D6 | |
| SCHEMBL11733722 | 0.82 | CYP2C9 (0.55) | BRD4ADRB2CYP2C9MEN1CYP2D6 | |
| Bromide SCHEMBL10989191 | 0.80 | ADRB2 (0.46) | BRD4ADRB2CYP2C9MEN1CYP2D6 | |
| Hydrochloric Acid SCHEMBL29398375 | 0.80 | CYP2C9 (0.53) | BRD4ADRB2CYP2C9MEN1CYP2D6 | |
| Hydrochloric Acid SCHEMBL28011489 | 0.80 | CYP2C9 (0.53) | BRD4ADRB2CYP2C9MEN1CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108558787-A | A kind of preparation method of high-efficiency low-toxicity acaricide Hexythiazox | 江苏禾本生化有限公司 | 2018-09-21 | — | — | CN | claimed |
| CN-108558787-A | A kind of preparation method of high-efficiency low-toxicity acaricide Hexythiazox | 江苏禾本生化有限公司 | 2018-09-21 | — | — | CN | disclosed |