Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B3 | P37058 | 8/20 | 0.50 |
| ▸ | MAOB | P27338 | 4/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | GLA | P06280 | 2/20 | 0.47 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.46 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.45 |
| ▸ | LCK | P06239 | 1/20 | 0.45 |
| ▸ | FYN | P06241 | 1/20 | 0.45 |
| ▸ | GRB2 | P62993 | 1/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | KDR | P35968 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28509796 | 0.88 | MAOB (0.56) | MAOBALDH1A1KDM4ELCKCYP19A1 | |
| SCHEMBL28906428 | 0.87 | MAOB (0.57) | MAOB | |
| SCHEMBL28519970 | 0.85 | MAOB (0.58) | MAOBCYP19A1 | |
| SCHEMBL28507799 | 0.85 | MAOB (0.59) | MAOBTDP1NPC1 | |
| SCHEMBL28907092 | 0.84 | MAOB (0.60) | MAOBCYP19A1NPC1 | |
| SCHEMBL28515760 | 0.84 | MAOB (0.59) | MAOBALDH1A1GAAKDM4EGLA | |
| SCHEMBL28521295 | 0.83 | MAOB (0.61) | MAOBCYP19A1 | |
| SCHEMBL28515254 | 0.83 | MAOB (0.61) | MAOBCYP19A1 | |
| SCHEMBL28512434 | 0.82 | MAOB (0.63) | MAOBCA12CA9 | |
| SCHEMBL28509798 | 0.81 | MAOB (0.62) | MAOBCYP19A1 |
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-109761964-B | Coumarin-3-hydroxypyridine-4-one derivative, and preparation method and application thereof | 浙江工业大学 | 2021-02-02 | — | — | CN | disclosed |