Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 3/20 | 0.71 |
| ▸ | RELA | Q04206 | 1/20 | 0.56 |
| ▸ | ESR1 | P03372 | 2/20 | 0.53 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.53 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.53 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.53 |
| ▸ | TUBB1 | Q9H4B7 | 2/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | ABL1 | P00519 | 1/20 | 0.53 |
| ▸ | TTR | P02766 | 1/20 | 0.53 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.53 |
| ▸ | BCR | P11274 | 1/20 | 0.53 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.53 |
| ▸ | NQO2 | P16083 | 1/20 | 0.53 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.53 |
| ▸ | TUBB | P07437 | 1/20 | 0.53 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.53 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.53 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL18144159 | 1.00 | AHR (0.71) | AHRRELAESR1CYP1A1PTGS2 | |
| SCHEMBL18144154 | 1.00 | AHR (0.71) | AHRRELAESR1CYP1A1PTGS2 | |
| SCHEMBL18144142 | 0.89 | CYP1A1 (0.61) | AHRRELAESR1CYP1A1PTGS2 | |
| SCHEMBL18144139 | 0.89 | CYP1A1 (0.61) | AHRRELAESR1CYP1A1PTGS2 | |
| SCHEMBL6461016 | 0.84 | AHR (1.00) | AHRRELAESR1CYP1A1PTGS2 | |
| SCHEMBL6471618 | 0.84 | AHR (1.00) | AHRRELAESR1CYP1A1PTGS2 | |
| SCHEMBL6471614 | 0.84 | AHR (1.00) | AHRRELAESR1CYP1A1PTGS2 | |
| SCHEMBL18144100 | 0.80 | CYP1A1 (0.67) | AHRRELAESR1CYP1A1PTGS2 | |
| SCHEMBL18144097 | 0.80 | CYP1A1 (0.67) | AHRRELAESR1CYP1A1PTGS2 | |
| SCHEMBL18144113 | 0.80 | AHR (0.77) | AHRRELAESR1CYP1A1PTGS2 |
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-118044519-A | Molecules having pesticidal utility, and intermediates, compositions and methods related thereto | 科迪华农业科技有限责任公司 | 2024-05-17 | — | — | CN | disclosed |
| CN-110072842-B | Molecules having pesticidal utility, and intermediates, compositions and methods related thereto | 科迪华农业科技有限责任公司 | 2024-02-02 | — | — | CN | disclosed |