Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ENPP2 | Q13822 | 1/20 | 0.46 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.41 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL6768917 | 0.81 | ENPP2 (0.56) | ENPP2DRD2DRD1TAAR1CYP3A4 | |
| SCHEMBL8752286 | 0.79 | TRPA1 (0.47) | TAAR1CYP3A4CYP1A2PKMSLC6A2 | |
| SCHEMBL19342844 | 0.78 | ADRB1 (0.50) | ENPP2PLA2G1BDRD2DRD1TAAR1 | |
| SCHEMBL4537386 | 0.77 | ENPP2 (0.44) | ENPP2DRD2DRD1TAAR1CYP3A4 | |
| SCHEMBL7791226 | 0.76 | ENPP2 (0.50) | ENPP2DRD2DRD1TAAR1CYP3A4 | |
| SCHEMBL11818165 | 0.74 | DRD2 (0.50) | ENPP2DRD2DRD1TAAR1CYP3A4 | |
| Gepefrine SCHEMBL2562808 | 0.73 | TAAR1 (0.61) | ENPP2DRD2DRD1TAAR1CYP3A4 | |
| Enterodiol SCHEMBL2641390 | 0.73 | ENPP2 (0.52) | ENPP2DRD2DRD1TAAR1CYP3A4 | |
| Gepefrine SCHEMBL149774 | 0.73 | TAAR1 (0.61) | ENPP2DRD2DRD1TAAR1CYP3A4 | |
| SCHEMBL629959 | 0.73 | CHRM2 (0.53) | ENPP2DRD2DRD1TAAR1CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117683004-A | Eucommia ulmoides in-vivo metabolite and preparation method and application thereof | 天津中医药大学 | 2024-03-12 | — | — | CN | claimed |
| CN-117683004-A | Eucommia ulmoides in-vivo metabolite and preparation method and application thereof | 天津中医药大学 | 2024-03-12 | — | — | CN | disclosed |
| CN-117683004-A | Eucommia ulmoides in-vivo metabolite and preparation method and application thereof | 天津中医药大学 | 2024-03-12 | — | — | CN | disclosed |