Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGXT | P21549 | 1/20 | 0.58 |
| ▸ | ITGB3 | P05106 | 2/20 | 0.56 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.55 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | POLB | P06746 | 2/20 | 0.55 |
| ▸ | USP2 | O75604 | 1/20 | 0.55 |
| ▸ | BLM | P54132 | 1/20 | 0.55 |
| ▸ | KCNQ2 | O43526 | 2/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.53 |
| ▸ | CNR1 | P21554 | 1/20 | 0.47 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.46 |
| ▸ | KLK1 | P06870 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29639816 | 0.98 | AGXT (0.56) | AGXTITGB3ITGA2BKDM4EALDH1A1 | |
| SCHEMBL20392367 | 0.97 | ITGB3 (0.56) | AGXTITGB3ITGA2BKDM4EALDH1A1 | |
| SCHEMBL5177552 | 0.86 | AGXT (0.61) | AGXTITGB3ITGA2BMEN1KMT2A | |
| SCHEMBL5790195 | 0.86 | AGXT (0.61) | AGXTITGB3ITGA2BHTR1AHTR2A | |
| SCHEMBL17115677 | 0.84 | AGXT (0.58) | AGXTITGB3ITGA2BKDM4EALDH1A1 | |
| SCHEMBL16880373 | 0.82 | ITGB3 (0.64) | AGXTITGB3ITGA2BKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL23929053 | 0.81 | PRMT6 (0.57) | AGXTITGB3ITGA2BKDM4EALDH1A1 | |
| SCHEMBL17115681 | 0.81 | AGXT (0.54) | AGXTITGB3ITGA2BKDM4EALDH1A1 | |
| SCHEMBL30616970 | 0.81 | ITGB3 (0.50) | ITGB3ITGA2BKDM4EALDH1A1MEN1 | |
| SCHEMBL15709650 | 0.80 | PRMT6 (0.56) | AGXTITGB3ITGA2BKDM4EALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109563043-A | SUBSTITUTED PYRIDINES AS INHIBITORS OF DNMT1 | 葛兰素史密斯克莱知识产权发展有限公司 | 2019-04-02 | — | — | CN | claimed |
| CN-109563043-B | Substituted pyridines as inhibitors of DNMT1 | 葛兰素史密斯克莱知识产权发展有限公司 | 2022-05-31 | — | — | CN | disclosed |
| CN-104936954-A | compounds and methods of use thereof | AGIOS PHARMACEUTICALS INC | 2015-09-23 | — | — | CN | disclosed |