Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.37 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.36 |
| ▸ | HCAR3 | P49019 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.34 |
| ▸ | GCK | P35557 | 3/20 | 0.34 |
| ▸ | ACACB | O00763 | 2/20 | 0.34 |
| ▸ | RAF1 | P04049 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | RARG | P13631 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30016380 | 1.00 | FFAR4 (0.37) | FFAR4MRGPRX4HCAR3ALDH1A1KDM4E | |
| SCHEMBL28646014 | 0.89 | KDM4E (0.50) | FFAR4ALDH1A1KDM4EACACBRAF1 | |
| SCHEMBL28925140 | 0.82 | MRGPRX4 (0.33) | MRGPRX4PLA2G2ARAF1 | |
| SCHEMBL19330200 | 0.82 | KDM4E (0.53) | ALDH1A1KDM4EHTT | |
| SCHEMBL30340556 | 0.82 | KDM4E (0.53) | ALDH1A1KDM4EHTT | |
| SCHEMBL3714048 | 0.79 | TAS1R3 (0.40) | FFAR4HCAR3ALDH1A1KDM4EPLA2G2A | |
| SCHEMBL30017038 | 0.77 | TPMT (0.38) | MRGPRX4ALDH1A1KDM4E | |
| SCHEMBL21349298 | 0.77 | TPMT (0.38) | MRGPRX4ALDH1A1KDM4E | |
| SCHEMBL89628 | 0.76 | KDM4E (0.50) | FFAR4HCAR3ALDH1A1KDM4EPLA2G2A | |
| SCHEMBL2711725 | 0.75 | KDM4E (0.46) | ALDH1A1KDM4E |
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-113264945-B | Spiro derivative, preparation method and medical application thereof | 江苏恒瑞医药股份有限公司 | 2022-11-22 | — | — | CN | disclosed |
| CN-113264945-A | Spiro derivative, preparation method and medical application thereof | 江苏恒瑞医药股份有限公司 | 2021-08-17 | — | — | CN | disclosed |