Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 12/20 | 0.70 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.70 |
| ▸ | TP53 | P04637 | 5/20 | 0.70 |
| ▸ | NPC1 | O15118 | 5/20 | 0.70 |
| ▸ | RAB9A | P51151 | 5/20 | 0.70 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.70 |
| ▸ | MEN1 | O00255 | 2/20 | 0.70 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.70 |
| ▸ | POLB | P06746 | 2/20 | 0.58 |
| ▸ | MAOA | P21397 | 1/20 | 0.56 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.56 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.55 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.55 |
| ▸ | UTRN | P46939 | 1/20 | 0.54 |
| ▸ | ESR1 | P03372 | 1/20 | 0.53 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL19806580 | 0.90 | MAPT (0.85) | MAPTKDM4EALDH1A1TP53NPC1 | |
| SCHEMBL2249285 | 0.89 | MAOA (0.57) | MAPTKDM4EALDH1A1TP53NPC1 | |
| SCHEMBL2739309 | 0.87 | MAPT (0.76) | MAPTKDM4EALDH1A1TP53NPC1 | |
| SCHEMBL19379995 | 0.82 | RAB9A (1.00) | MAPTKDM4EALDH1A1TP53NPC1 | |
| SCHEMBL23380379 | 0.82 | KDM4E (0.78) | MAPTKDM4EALDH1A1TP53NPC1 | |
| SCHEMBL2739327 | 0.81 | MAPT (0.76) | MAPTKDM4EALDH1A1TP53NPC1 | |
| SCHEMBL14275901 | 0.81 | MAPT (0.76) | MAPTKDM4EALDH1A1TP53NPC1 | |
| SCHEMBL29819651 | 0.81 | MAPT (0.76) | MAPTKDM4EALDH1A1TP53NPC1 | |
| SCHEMBL23373921 | 0.80 | NPC1 (0.69) | MAPTKDM4EALDH1A1TP53NPC1 | |
| SCHEMBL3951712 | 0.79 | ESR1 (0.56) | MAPTKDM4EALDH1A1TP53NPC1 |
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-2023279986-A1 | SIX-MEMBERED ARYL OR HETEROARYL AMIDES, AND COMPOSITION AND USE THEREOF | 贝达药业股份有限公司 | 2023-01-12 | — | — | WO | disclosed |