Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.44 |
| ▸ | TEAD1 | P28347 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | NPY2R | P49146 | 1/20 | 0.40 |
| ▸ | MLNR | O43193 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 2/20 | 0.40 |
| ▸ | ACHE | P22303 | 2/20 | 0.40 |
| ▸ | BACE1 | P56817 | 2/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | PHGDH | O43175 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.37 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL31285937 | 0.87 | MLNR (0.53) | SIGMAR1TEAD1MLNRPTGS1POLB | |
| SCHEMBL22588174 | 0.87 | MLNR (0.53) | SIGMAR1TEAD1MLNRPTGS1POLB | |
| SCHEMBL22605799 | 0.80 | SIGMAR1 (0.43) | SIGMAR1TEAD1MAPTMLNRPHGDH | |
| SCHEMBL22588324 | 0.76 | KDM1A (0.45) | KDM4EGAAMAPTMLNRHDAC2 | |
| SCHEMBL22605825 | 0.76 | MLNR (0.53) | SIGMAR1TEAD1MLNRNPSR1 | |
| SCHEMBL31285938 | 0.76 | KDM1A (0.45) | KDM4EGAAMAPTMLNRHDAC2 | |
| SCHEMBL22605589 | 0.75 | MLNR (0.54) | SIGMAR1TEAD1MLNRNPSR1POLB | |
| SCHEMBL22587771 | 0.74 | MLNR (0.52) | SIGMAR1TEAD1MLNRPOLB | |
| SCHEMBL22605540 | 0.74 | POLB (0.53) | SIGMAR1TEAD1MLNRNPSR1POLB | |
| SCHEMBL22605523 | 0.73 | MLNR (0.52) | TEAD1MLNRNPSR1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111848598-B | Heterocyclic compound, application thereof and composition containing same | 健艾仕生物医药有限公司 | 2024-12-10 | — | — | CN | disclosed |
| CN-111848598-A | Heterocyclic ring-containing compound, application thereof and composition containing heterocyclic ring-containing compound | 健艾仕生物医药有限公司 | 2020-10-30 | — | — | CN | disclosed |