Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 8/20 | 0.38 |
| ▸ | HTR2C | P28335 | 5/20 | 0.38 |
| ▸ | AKT1 | P31749 | 5/20 | 0.33 |
| ▸ | AHR | P35869 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CIT | O14578 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | PRKCB | P05771 | 1/20 | 0.33 |
| ▸ | PRKCA | P17252 | 1/20 | 0.33 |
| ▸ | PRKACA | P17612 | 1/20 | 0.33 |
| ▸ | PRKACB | P22694 | 1/20 | 0.33 |
| ▸ | AKT2 | P31751 | 1/20 | 0.33 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.33 |
| ▸ | PKN1 | Q16512 | 1/20 | 0.33 |
| ▸ | PRKD2 | Q9BZL6 | 1/20 | 0.33 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL15353188 | 0.86 | HTR2A (0.38) | HTR2AHTR2CAKT1AHRKMT2A | |
| SCHEMBL675149 | 0.71 | ALDH1A1 (0.46) | KDM4EALDH1A1 | |
| SCHEMBL1529738 | 0.71 | AKT1 (0.50) | HTR2AHTR2CAKT1AHRKMT2A | |
| SCHEMBL1529600 | 0.71 | AKT1 (0.51) | HTR2AHTR2CAKT1KDM4EALDH1A1 | |
| SCHEMBL1682693 | 0.71 | KMT2A (0.36) | HTR2AHTR2CAKT1AHRKMT2A | |
| SCHEMBL1529826 | 0.70 | DAO (0.42) | HTR2AHTR2CAKT1AHRKMT2A | |
| SCHEMBL11903991 | 0.70 | BCAT2 (0.44) | HTR2AHTR2CAKT1AHRKMT2A | |
| SCHEMBL18420843 | 0.70 | TSHR (0.46) | HTR2AHTR2CAKT1 | |
| SCHEMBL17130127 | 0.69 | HTR2A (0.38) | HTR2AHTR2CAKT1AHRKMT2A | |
| SCHEMBL1529755 | 0.69 | AKT1 (0.53) | AKT1ROCK2PRKCBPRKCAPRKACA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023088257-A1 | PICROPODOPHYLLOTOXIN DERIVATIVE, PHARMACEUTICAL COMPOSITION COMPRISING SAME AND USE THEREOF | 杭州拿因生物科技有限责任公司 | 2023-05-25 | — | — | WO | disclosed |