Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | SCN1A | P35498 | 1/20 | 0.34 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.34 |
| ▸ | MPO | P05164 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | GABRP | O00591 | 1/20 | 0.32 |
| ▸ | GABRD | O14764 | 1/20 | 0.32 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.32 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.32 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.32 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL30826838 | 0.79 | TLR8 (0.37) | ABCB11LMNACYP1A2CYP2D6SCN1A | |
| SCHEMBL22028999 | 0.79 | TLR8 (0.37) | ABCB11LMNACYP1A2CYP2D6SCN1A | |
| SCHEMBL34465304 | 0.73 | CYP2A6 (0.44) | KDM4ELMNATDP1ALDH1A1NPC1 | |
| SCHEMBL249045 | 0.73 | CYP2A6 (0.44) | KDM4ELMNATDP1ALDH1A1NPC1 | |
| SCHEMBL6961145 | 0.69 | PDE10A (0.36) | ALDH1A1 | |
| SCHEMBL153619 | 0.68 | PDE10A (0.35) | KDM4ETLR8 | |
| SCHEMBL29779695 | 0.68 | PDE10A (0.35) | KDM4ETLR8 | |
| SCHEMBL637337 | 0.68 | KDM4E (0.53) | KDM4ELMNACYP1A2ALDH1A1NPC1 | |
| SCHEMBL4266314 | 0.68 | KDM4E (0.53) | KDM4ECYP1A2TDP1ALDH1A1NPC1 | |
| SCHEMBL24373348 | 0.67 | KDM4E (0.49) | KDM4ECYP1A2CYP2D6ALDH1A1NPC1 |
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-117903192-A | Preparation method of 3-methoxy isoquinoline compound intermediate | 上海相辉医药科技有限公司 | 2024-04-19 | — | — | CN | disclosed |