Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGM2 | P21980 | 1/20 | 0.53 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.39 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.38 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | TDO2 | P48775 | 6/20 | 0.35 |
| ▸ | CES1 | P23141 | 1/20 | 0.35 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.35 |
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.34 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.33 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17038530 | 0.84 | L3MBTL1 (0.49) | TGM2PDE3BPDE3ACYP2A6CYP2B6 | |
| SCHEMBL4586483 | 0.70 | TGM2 (1.00) | TGM2CES1DNMT1ALDH1A1ALDH2 | |
| SCHEMBL30288310 | 0.70 | TGM2 (1.00) | TGM2CES1DNMT1ALDH1A1ALDH2 | |
| SCHEMBL3093670 | 0.67 | TGM2 (0.67) | TGM2PDE3BPDE3AL3MBTL1CES1 | |
| SCHEMBL12069195 | 0.67 | TGM2 (0.67) | TGM2CES1DNMT1ALDH1A1ALDH2 | |
| SCHEMBL2062557 | 0.67 | CES1 (0.67) | TGM2CES1DNMT1ALDH1A1ALDH2 | |
| SCHEMBL30762529 | 0.67 | TGM2 (0.67) | TGM2CES1DNMT1ALDH1A1ALDH2 | |
| SCHEMBL10304944 | 0.66 | CYP3A4 (0.57) | CYP2A6CYP2B6CYP3A4CYP2C19TDO2 | |
| SCHEMBL17038519 | 0.65 | L3MBTL1 (0.55) | TGM2L3MBTL1CES1 | |
| SCHEMBL26104326 | 0.64 | CYP2A6 (0.64) | CYP2A6CYP2B6CYP3A4CYP2C19CYP2E1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015126149-A1 | ISATIN DERIVATIVE AND METHOD FOR PREPARING SAME | 주식회사 대웅제약 | 2015-08-27 | — | — | WO | disclosed |