Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | SNCA | P37840 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | HTT | P42858 | 3/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL31723221 | 0.76 | ABCG2 (0.38) | NPC1RAB9AKMT2AABCG2 | |
| SCHEMBL22232350 | 0.76 | ABCG2 (0.38) | NPC1RAB9AKMT2AABCG2 | |
| SCHEMBL29454066 | 0.76 | ABCG2 (0.38) | NPC1RAB9AKMT2AABCG2 | |
| SCHEMBL28645302 | 0.73 | ABCG2 (0.36) | KDM4EMAPTHPGDALDH1A1NPC1 | |
| SCHEMBL28639938 | 0.70 | HSD17B1 (0.36) | GAAMAPTHPGDALDH1A1HSP90AA1 | |
| SCHEMBL24458098 | 0.69 | GAA (0.44) | GAAKDM4EMAPTHPGDALDH1A1 | |
| SCHEMBL8569593 | 0.69 | GAA (0.48) | GAAALDH1A1HDAC1HDAC6SMN1; SMN2 | |
| SCHEMBL19027676 | 0.68 | HTT (0.42) | KDM4EMAPTHPGDALDH1A1HDAC1 | |
| SCHEMBL22231907 | 0.68 | ABCG2 (0.36) | GAAALDH1A1SNCAKMT2AABCG2 | |
| SCHEMBL29454192 | 0.68 | ABCG2 (0.36) | GAAALDH1A1SNCAKMT2AABCG2 |
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-113454063-A | 3-substituted phenylamidine compounds, preparation method and application thereof | PI工业有限公司 | 2021-09-28 | — | — | CN | claimed |