Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RXRA | P19793 | 5/20 | 0.47 |
| ▸ | RXRB | P28702 | 4/20 | 0.47 |
| ▸ | RXRG | P48443 | 4/20 | 0.47 |
| ▸ | PTGDR2 | Q9Y5Y4 | 5/20 | 0.45 |
| ▸ | MGLL | Q99685 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.41 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.41 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.41 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.41 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.41 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.41 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.41 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.41 |
| ▸ | PPARD | Q03181 | 5/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7341566 | 0.88 | PTGDR2 (0.48) | RXRARXRBRXRGPTGDR2KDM4E | |
| SCHEMBL8081337 | 0.85 | CAMK2A (0.56) | RXRARXRBRXRGKDM4EUSP2 | |
| SCHEMBL7344505 | 0.85 | CXCL8 (0.44) | RXRARXRBRXRGMGLLKDM4E | |
| SCHEMBL7336152 | 0.84 | KDM2B (0.49) | PTGDR2MGLLKDM4EMAPT | |
| SCHEMBL21198383 | 0.83 | NR1H4 (0.55) | RXRARXRBRXRGPTGDR2KDM4E | |
| SCHEMBL31306660 | 0.83 | NR1H4 (0.55) | RXRARXRBRXRGPTGDR2KDM4E | |
| Hydrochloric Acid SCHEMBL7339634 | 0.82 | ALDH1A1 (0.42) | RXRARXRBRXRGPTGDR2KDM4E | |
| SCHEMBL26035206 | 0.81 | CYP2C19 (0.62) | RXRARXRBRXRGPTGDR2KDM4E | |
| SCHEMBL8092961 | 0.80 | KDM4E (0.45) | KDM4EALDH1A1HSD17B10PPARDPPARA | |
| SCHEMBL7333637 | 0.80 | CXCL8 (0.55) | MAPTHTT |
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 |
|---|---|---|---|---|---|---|---|
| US-5968938-A | Piperazine oxytocin receptor antagonists | MERCK & CO., INC. (US) | 1999-10-19 | — | — | US | disclosed |