Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK14 | Q16539 | 1/20 | 0.39 |
| ▸ | FLT3 | P36888 | 1/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.35 |
| ▸ | F12 | P00748 | 1/20 | 0.35 |
| ▸ | TGFBR1 | P36897 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ERN1 | O75460 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30997264 | 0.84 | MAPT (0.39) | MAPK14FLT3MCL1TP53GAA | |
| SCHEMBL11328355 | 0.81 | TGFBR1 (0.40) | MAPK14TGFBR1MAPTLMNANPC1 | |
| SCHEMBL31003054 | 0.67 | KDM4E (0.39) | THRBMAPTGRM5LMNANPC1 | |
| SCHEMBL15813304 | 0.67 | KDM4E (0.39) | THRBMAPTGRM5LMNANPC1 | |
| SCHEMBL20456716 | 0.66 | ERN1 (0.47) | TP53LMNASMN1; SMN2NPC1RAB9A | |
| SCHEMBL29823937 | 0.66 | GRM5 (0.40) | MAPK14TGFBR1TP53GAAMAPT | |
| SCHEMBL13932934 | 0.64 | TGFBR1 (0.58) | MAPK14THRBTGFBR1 | |
| SCHEMBL4873558 | 0.64 | MAPK14 (0.67) | MAPK14THRBMCL1TGFBR1 | |
| SCHEMBL28619424 | 0.64 | PTGS2 (0.40) | MAPTLMNASMN1; SMN2NPC1RAB9A | |
| SCHEMBL15173172 | 0.63 | ERN1 (0.43) | TP53MAPTLMNASMN1; SMN2NPC1 |
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-118556061-A | Disubstituted octahydropyrrolo [3,4-c ] pyrrole methyl ketone derivative and application thereof | 江苏恩华药业股份有限公司 | 2024-08-27 | — | — | CN | disclosed |