Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | CASP7 | P55210 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | PRKCI | P41743 | 1/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | VHL | P40337 | 1/20 | 0.30 |
| ▸ | ELOC | Q15369 | 1/20 | 0.30 |
| ▸ | ELOB | Q15370 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11663902 | 1.00 | KDM4E (0.41) | KDM4EALDH1A1HPGDMAPTCASP1 | |
| SCHEMBL31620328 | 0.89 | MAOA (0.41) | KDM4EALDH1A1HPGDMAPTHSD17B10 | |
| SCHEMBL8557216 | 0.79 | NOTUM (0.44) | KDM4EALDH1A1HPGDMAPTCASP1 | |
| SCHEMBL17604845 | 0.76 | KDM4E (0.41) | KDM4EALDH1A1HPGDMAPTCASP1 | |
| SCHEMBL3989388 | 0.76 | KDM4E (0.41) | KDM4EALDH1A1HPGDCASP1CASP7 | |
| SCHEMBL296542 | 0.76 | KDM4E (0.41) | KDM4EALDH1A1HPGDCASP1CASP7 | |
| SCHEMBL31125679 | 0.76 | KDM4E (0.41) | KDM4EALDH1A1HPGDCASP1CASP7 | |
| SCHEMBL15287071 | 0.76 | CASP1 (0.41) | KDM4EALDH1A1HPGDMAPTCASP1 | |
| SCHEMBL22102587 | 0.76 | KDM4E (0.41) | KDM4EALDH1A1HPGDMAPTCASP1 | |
| SCHEMBL28972015 | 0.76 | HPGD (0.41) | KDM4EALDH1A1HPGDMAPTCASP1 |
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-113195492-B | Novel compound with three-fused ring structure, preparation method and application thereof | 信达生物制药(苏州)有限公司 | 2022-07-08 | — | — | CN | disclosed |