Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR3 | P49019 | 3/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | GRM5 | P41594 | 1/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.35 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.34 |
| ▸ | TRPM8 | Q7Z2W7 | 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 | |
|---|---|---|---|---|
| SCHEMBL12844433 | 0.89 | HCAR3 (0.42) | HCAR3HDAC4NAMPTHRH3GRM5 | |
| SCHEMBL29133579 | 0.85 | GRM5 (0.51) | GRM5MAPTHPGDTDP1KMT2A | |
| SCHEMBL20812007 | 0.80 | HDAC1 (0.50) | HCAR3HDAC4NAMPTHRH3GRM5 | |
| SCHEMBL3247777 | 0.79 | NAPRT (0.53) | GRM5MAPTKMT2AMEN1NPC1 | |
| SCHEMBL28630671 | 0.77 | P4HTM (0.58) | HCAR3MAPTTDP1KMT2AMEN1 | |
| SCHEMBL31098145 | 0.77 | KCNJ1 (0.45) | HCAR3MAPTHPGDKMT2AMEN1 | |
| SCHEMBL2749675 | 0.77 | KCNJ1 (0.45) | HCAR3MAPTHPGDKMT2AMEN1 | |
| SCHEMBL14518464 | 0.76 | HDAC4 (0.51) | HDAC4NAMPTPDK2MAPTHPGD | |
| SCHEMBL23991556 | 0.76 | HRH3 (0.40) | HCAR3HDAC4NAMPTHRH3GRM5 | |
| SCHEMBL12776421 | 0.76 | MLYCD (0.43) | HCAR3HDAC4NAMPTHRH3GRM5 |
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-116354894-A | Substituted piperazine compound and application thereof in medicines | 广东东阳光药业有限公司 | 2023-06-30 | — | — | CN | disclosed |