Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 6/20 | 0.52 |
| ▸ | CDK4 | P11802 | 3/20 | 0.48 |
| ▸ | CCND1 | P24385 | 3/20 | 0.48 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.44 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.44 |
| ▸ | DRD1 | P21728 | 2/20 | 0.41 |
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | DRD5 | P21918 | 1/20 | 0.41 |
| ▸ | IDO1 | P14902 | 2/20 | 0.41 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.40 |
| ▸ | F7 | P08709 | 1/20 | 0.40 |
| ▸ | F3 | P13726 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL31070555 | 0.89 | KIF11 (0.47) | KIF11CDK4CCND1OPRM1OPRK1 | |
| SCHEMBL31083748 | 0.88 | KIF11 (0.48) | KIF11CDK4CCND1OPRM1OPRK1 | |
| SCHEMBL30593351 | 0.87 | SLC6A4 (0.49) | CDK4CCND1OPRM1OPRK1OPRL1 | |
| SCHEMBL30593300 | 0.87 | DRD2 (0.49) | KIF11DRD1DRD2DRD5 | |
| SCHEMBL30593296 | 0.86 | DRD2 (0.41) | KIF11DRD1DRD2DRD5 | |
| SCHEMBL29084839 | 0.86 | DRD2 (0.41) | KIF11DRD1DRD2DRD5 | |
| SCHEMBL31083717 | 0.85 | CHRM3 (0.40) | KIF11DRD1DRD2DRD5IDO1 | |
| SCHEMBL30593235 | 0.84 | DRD2 (0.42) | KIF11DRD1DRD2DRD5IDO1 | |
| SCHEMBL30593222 | 0.84 | APP (0.42) | KIF11DRD1DRD2DRD5 | |
| SCHEMBL29084876 | 0.84 | APP (0.42) | KIF11DRD1DRD2DRD5 |
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-118742543-A | Dihydro isoquinoline compound and medical application thereof | 中国科学院上海药物研究所 | 2024-10-01 | — | — | CN | disclosed |
| CN-116789641-A | Dihydro isoquinoline compound and medical application thereof | 中国科学院上海药物研究所 | 2023-09-22 | — | — | CN | disclosed |