Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 11/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.43 |
| ▸ | NOS3 | P29474 | 1/20 | 0.38 |
| ▸ | NOS2 | P35228 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29164929 | 0.81 | LMNA (0.65) | MAOBLMNACYP19A1CNR1NOS3 | |
| SCHEMBL14939611 | 0.77 | CYP19A1 (0.55) | CYP19A1NOS3NOS2KDM4E | |
| SCHEMBL10426191 | 0.75 | MAOB (0.74) | MAOBCYP19A1KDM4EADORA3AR | |
| SCHEMBL10426189 | 0.75 | MAOB (0.74) | MAOBCYP19A1KDM4EADORA3AR | |
| SCHEMBL28847777 | 0.71 | LDHA (0.53) | MAOBLMNACYP19A1CNR1KDM4E | |
| SCHEMBL29165047 | 0.69 | MAOB (0.51) | MAOBLMNACYP19A1KDM4EADORA3 | |
| SCHEMBL4358992 | 0.69 | AR (0.73) | MAOBCYP19A1ADORA3AR | |
| SCHEMBL1823831 | 0.69 | AR (0.58) | MAOBCYP19A1KDM4EADORA3AR | |
| SCHEMBL28730833 | 0.68 | CYP19A1 (0.41) | MAOBCYP19A1KDM4E | |
| SCHEMBL28730835 | 0.68 | CYP19A1 (0.41) | MAOBCYP19A1KDM4E |
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-110128393-B | Preparation method of substituted isocoumarin derivative | 华侨大学 | 2022-09-30 | — | — | CN | disclosed |