Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 1/20 | 0.45 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.43 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.43 |
| ▸ | CNR1 | P21554 | 2/20 | 0.36 |
| ▸ | CNR2 | P34972 | 2/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | INHA | P05111 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.36 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.36 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.36 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.36 |
| ▸ | TRPV2 | Q9Y5S1 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL28266636 | 0.76 | PTPN1 (0.42) | OPRM1OPRD1OPRK1 | |
| SCHEMBL28344147 | 0.72 | OPRM1 (0.39) | OPRM1OPRD1CNR1CNR2ALOX5 | |
| SCHEMBL1954867 | 0.72 | CYP19A1 (0.59) | CYP19A1NPC1HPGDMAPK1HTT | |
| SCHEMBL23686901 | 0.68 | CYP19A1 (0.45) | CYP19A1NPC1HPGDMAPK1HTT | |
| SCHEMBL31305304 | 0.67 | CYP19A1 (0.54) | CYP19A1NPC1HPGDMAPK1HTT | |
| SCHEMBL3915407 | 0.67 | OPRM1 (0.57) | OPRM1OPRD1TRPV1OPRK1 | |
| SCHEMBL20357469 | 0.66 | NPC1 (0.65) | CYP19A1NPC1HPGDMAPK1HTT | |
| SCHEMBL9752680 | 0.64 | CYP19A1 (0.51) | CYP19A1SLC6A3NPC1HPGDMAPK1 | |
| SCHEMBL31545838 | 0.63 | TYR (0.51) | CYP19A1TRPV1NPC1HPGDMAPK1 | |
| SCHEMBL28841857 | 0.62 | CYP19A1 (0.49) | CYP19A1NPC1HPGDMAPK1HTT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110511202-A | Polycyclic polyisocyanate pentenyl acyl phloroglucinol class compound and the preparation method and application thereof | UNIV XIAMEN | 2019-11-29 | — | — | CN | claimed |
| CN-110511202-A | Polycyclic polyisocyanate pentenyl acyl phloroglucinol class compound and the preparation method and application thereof | UNIV XIAMEN | 2019-11-29 | — | — | CN | disclosed |
| CN-110511202-A | Polycyclic polyisocyanate pentenyl acyl phloroglucinol class compound and the preparation method and application thereof | UNIV XIAMEN | 2019-11-29 | — | — | CN | disclosed |
| CN-110511202-A | Polycyclic polyisocyanate pentenyl acyl phloroglucinol class compound and the preparation method and application thereof | UNIV XIAMEN | 2019-11-29 | — | — | CN | disclosed |