Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CD274 | Q9NZQ7 | 3/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | DRD2 | P14416 | 1/20 | 0.49 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.49 |
| ▸ | HTR2C | P28335 | 1/20 | 0.49 |
| ▸ | TDO2 | P48775 | 9/20 | 0.48 |
| ▸ | ASIC3 | Q9UHC3 | 2/20 | 0.48 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.48 |
| ▸ | PNMT | P11086 | 1/20 | 0.45 |
| ▸ | CD44 | P16070 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | ASH1L | Q9NR48 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL31070511 | 0.88 | NR4A2 (0.53) | HSD17B10TDO2NR4A2IMPDH2MAPK1 | |
| SCHEMBL25402840 | 0.77 | CD274 (0.61) | CD274DRD2ASIC3PNMTCD44 | |
| SCHEMBL30593259 | 0.74 | CD274 (0.51) | CD274DRD2ASIC3PNMTCD44 | |
| SCHEMBL25404671 | 0.74 | CD274 (0.51) | CD274DRD2ASIC3PNMTCD44 | |
| SCHEMBL25404459 | 0.74 | CD274 (0.51) | CD274DRD2ASIC3PNMTCD44 | |
| SCHEMBL31083759 | 0.74 | CD274 (0.51) | CD274DRD2ASIC3PNMTCD44 | |
| SCHEMBL6347388 | 0.74 | ASIC3 (0.65) | CD274DRD2ASIC3PNMTCD44 | |
| SCHEMBL4553211 | 0.74 | CD274 (0.60) | CD274DRD2ASIC3PNMTCD44 | |
| SCHEMBL28377762 | 0.73 | NR4A2 (0.81) | HSD17B10ALDH1A1MAPTTDO2NR4A2 | |
| SCHEMBL12156777 | 0.72 | ALDH1A1 (0.47) | HSD17B10KDM4EALDH1A1MAPTDRD2 |
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 |
| WO-2023174383-A1 | DIHYDROISOQUINOLINE COMPOUND AND MEDICAL USE THEREOF | 中国科学院上海药物研究所 | 2023-09-21 | — | — | WO | disclosed |