Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | SMAD3 | P84022 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10966470 | 0.76 | ALDH1A1 (0.52) | HPGDKMT2AALDH1A1MEN1BLM | |
| SCHEMBL10966952 | 0.74 | KDM4E (0.47) | HPGDKMT2AALDH1A1MEN1BLM | |
| SCHEMBL19721600 | 0.73 | MCHR1 (0.51) | HPGDKMT2AALDH1A1MEN1BLM | |
| SCHEMBL12169976 | 0.73 | ALDH1A1 (0.39) | HPGDKMT2AALDH1A1MEN1BLM | |
| Hydrochloric Acid SCHEMBL1448610 | 0.73 | KMT2A (0.51) | HPGDKMT2AALDH1A1MEN1CYP2C19 | |
| SCHEMBL9835140 | 0.72 | ALDH1A1 (0.57) | HPGDKMT2AALDH1A1MEN1BLM | |
| SCHEMBL28544385 | 0.71 | CASP1 (0.41) | KMT2AALDH1A1MEN1BLMCYP2C19 | |
| SCHEMBL9835390 | 0.70 | KDM4E (0.54) | HPGDKMT2AALDH1A1MEN1BLM | |
| SCHEMBL10994286 | 0.69 | ALDH1A1 (0.55) | HPGDKMT2AALDH1A1MEN1BLM | |
| SCHEMBL11880887 | 0.68 | ALDH1A1 (0.63) | HPGDALDH1A1CYP2C19KDM4EL3MBTL1 |
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 3 patents. 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 | claimed |
| 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 |
| 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 |