Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 5/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | IKBKB | O14920 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | GLA | P06280 | 5/20 | 0.40 |
| ▸ | HPGD | P15428 | 5/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | PTBP1 | P26599 | 1/20 | 0.40 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.40 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL23632474 | 0.86 | MEN1 (0.44) | GAAKMT2AMEN1NPC1RAB9A | |
| SCHEMBL28231808 | 0.86 | MEN1 (0.41) | GAAKMT2AMEN1NPC1RAB9A | |
| SCHEMBL28721102 | 0.85 | IKBKB (0.42) | GAAKMT2AMEN1NPC1RAB9A | |
| SCHEMBL28230815 | 0.84 | KMT2A (0.47) | GAAKMT2AMEN1NPC1RAB9A | |
| SCHEMBL29505627 | 0.84 | KMT2A (0.42) | GAAKMT2AMEN1NPC1RAB9A | |
| SCHEMBL29209989 | 0.84 | KMT2A (0.40) | GAAKMT2AMEN1NPC1RAB9A | |
| SCHEMBL28720824 | 0.84 | KMT2A (0.42) | GAAKMT2AMEN1NPC1RAB9A | |
| SCHEMBL28723805 | 0.83 | KMT2A (0.38) | GAAKMT2AMEN1NPC1RAB9A | |
| SCHEMBL28718245 | 0.81 | MEN1 (0.40) | GAAKMT2AMEN1NPC1RAB9A | |
| SCHEMBL28231761 | 0.78 | KMT2A (0.44) | GAAKMT2AMEN1NPC1RAB9A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111269217-B | Pyrimidinamine compound, preparation method and application thereof | 苏州信诺维医药科技有限公司 | 2021-01-08 | — | — | CN | disclosed |
| CN-111269217-A | Pyrimidinamine compound, preparation method and application thereof | 苏州信诺维医药科技有限公司 | 2020-06-12 | — | — | CN | disclosed |
| CN-110540538-A | Inhibitors of influenza virus replication | VERTEX PHARMA | 2019-12-06 | — | — | CN | disclosed |
| CN-105294655-A | CDK small-molecule inhibitor compounds and application therefore | GUANGDONG HEC PHARMACEUTICAL | 2016-02-03 | — | — | CN | disclosed |