Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDO2 | P48775 | 11/20 | 0.64 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.64 |
| ▸ | MEN1 | O00255 | 2/20 | 0.64 |
| ▸ | MAPT | P10636 | 2/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.64 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.64 |
| ▸ | GABRP | O00591 | 1/20 | 0.64 |
| ▸ | GABRD | O14764 | 1/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.64 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.64 |
| ▸ | HPGD | P15428 | 1/20 | 0.64 |
| ▸ | TSHR | P16473 | 1/20 | 0.64 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.64 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.64 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.64 |
| ▸ | MAOA | P21397 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL29543498 | 0.81 | TDO2 (0.64) | TDO2KDM4EMEN1MAPTMAPK1 | |
| SCHEMBL1798020 | 0.81 | TDO2 (0.64) | TDO2KDM4EMEN1MAPTMAPK1 | |
| SCHEMBL27817460 | 0.81 | TDO2 (0.80) | TDO2KDM4EMEN1MAPTMAPK1 | |
| Harman SCHEMBL29630272 | 0.78 | MAOA (1.00) | TDO2KDM4EMEN1MAPTMAPK1 | |
| SCHEMBL21714667 | 0.78 | TDO2 (0.64) | TDO2KDM4EMEN1MAPTMAPK1 | |
| Harman SCHEMBL9754741 | 0.78 | MAOA (1.00) | TDO2KDM4EMEN1MAPTMAPK1 | |
| Harman SCHEMBL9480937 | 0.78 | MAOA (1.00) | TDO2KDM4EMEN1MAPTMAPK1 | |
| SCHEMBL10020899 | 0.78 | TDO2 (0.64) | TDO2KDM4EMEN1MAPTMAPK1 | |
| Harman SCHEMBL141723 | 0.78 | MAOA (1.00) | TDO2KDM4EMEN1MAPTMAPK1 | |
| SCHEMBL7546861 | 0.78 | TDO2 (0.64) | TDO2KDM4EMEN1MAPTMAPK1 |
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-114057777-B | Beta-carboline derivative and preparation method and application thereof | 南方海洋科学与工程广东省实验室(湛江) | 2022-12-02 | — | — | CN | disclosed |