Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 1/20 | 0.41 |
| ▸ | CASP7 | P55210 | 1/20 | 0.41 |
| ▸ | BCHE | P06276 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 4/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ELANE | P08246 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12169976 | 0.73 | ALDH1A1 (0.39) | BCHEHTR2ATSHRLMNAKEAP1 | |
| SCHEMBL28544382 | 0.71 | HPGD (0.46) | HTR2ALMNAKMT2AMEN1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL1448610 | 0.66 | KMT2A (0.51) | TSHRKMT2AMEN1ALDH1A1TP53 | |
| SCHEMBL4553143 | 0.64 | KEAP1 (0.50) | BCHEHTR2ATSHRPOLBLMNA | |
| SCHEMBL4565599 | 0.62 | KEAP1 (0.48) | BCHEHTR2ATSHRPOLBLMNA | |
| SCHEMBL25936797 | 0.62 | KMT2A (0.44) | TSHRKMT2ANPSR1ALDH1A1SMN1; SMN2 | |
| SCHEMBL27724393 | 0.62 | KMT2A (0.43) | BCHEHTR2ATSHRPOLBKEAP1 | |
| Hydrochloric Acid SCHEMBL27678286 | 0.62 | KDM4E (0.44) | CASP1CASP7TSHRPOLBKMT2A | |
| SCHEMBL8300495 | 0.61 | KMT2A (0.65) | POLBLMNATHRBKMT2ANPSR1 | |
| SCHEMBL19748883 | 0.60 | BCHE (0.56) | BCHEHTR2ATSHRPOLBKEAP1 |
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-112645888-A | One-pot synthesis method of praziquantel intermediate | 厦门优孚利生物医药科技有限公司 | 2021-04-13 | — | — | CN | disclosed |