Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 4/20 | 0.48 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.47 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.47 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 2/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CA5A | P35218 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL11477785 | 0.73 | CHRNB2 (0.47) | CHRNB2CHRNA4CA2KDM1A | |
| SCHEMBL23095550 | 0.73 | KDM1A (0.48) | CHRNB2CHRNA4CA2KDM1A | |
| SCHEMBL26772711 | 0.73 | CHRNB2 (0.47) | CHRNB2CHRNA4CA2KDM1A | |
| SCHEMBL9749422 | 0.72 | BRD4 (0.45) | CYP19A1ESR1ESR2CA2CYP3A4 | |
| SCHEMBL14752221 | 0.72 | ENPP2 (0.38) | ALDH1A1CA2 | |
| SCHEMBL11005069 | 0.72 | OPRM1 (0.40) | CYP19A1OPRM1OPRD1OPRK1MAOA | |
| SCHEMBL7459638 | 0.71 | CHRNB2 (0.50) | CYP19A1CHRNB2CHRNA4DYRK1AESR1 | |
| SCHEMBL21524721 | 0.71 | CA2 (0.41) | CYP19A1ESR1ESR2CA2CYP3A4 | |
| SCHEMBL8590825 | 0.70 | DYRK1A (0.43) | CYP19A1CHRNB2CHRNA4DYRK1AOPRM1 | |
| SCHEMBL6276772 | 0.70 | OPRM1 (0.39) | CYP19A1OPRM1OPRD1OPRK1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115335431-A | Modified poly (phenylene ether) copolymers, compositions, and methods thereof | 高新特殊工程塑料全球技术有限公司 | 2022-11-11 | — | — | CN | disclosed |