Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | PTK2B | Q14289 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | HTR3A | P46098 | 2/20 | 0.37 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.37 |
| ▸ | HTR3B | O95264 | 1/20 | 0.37 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.37 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.37 |
| ▸ | HRH4 | Q9H3N8 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL27892685 | 0.79 | ADRB1 (0.53) | HTR3AHTR3EHTR3BHTR3DHTR3C | |
| SCHEMBL15474770 | 0.79 | DRD2 (0.37) | MAPTADRA2CKDM4EALDH1A1GAA | |
| SCHEMBL357979 | 0.79 | POLB (0.45) | MAPTKDM4EALDH1A1KMT2AHTR3A | |
| SCHEMBL28509462 | 0.79 | ALDH1A1 (0.41) | MAPTADRA2CKDM4EALDH1A1GAA | |
| SCHEMBL10770303 | 0.78 | MAPT (0.48) | MAPTKDM4EGAA | |
| SCHEMBL28029000 | 0.71 | DRD2 (0.46) | MAPTADRA2CKDM4EALDH1A1KMT2A | |
| SCHEMBL1852924 | 0.71 | ADRA2C (0.44) | MAPTADRA2CKDM4EALDH1A1GAA | |
| SCHEMBL27953744 | 0.70 | CYP1A2 (0.48) | ALDH1A1KMT2AHRH4 | |
| SCHEMBL18228156 | 0.69 | HRH4 (0.40) | MAPTADRA2CKDM4EALDH1A1GAA | |
| SCHEMBL81814 | 0.69 | MAPT (0.65) | MAPTADRA2CKDM4EALDH1A1GAA |
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-108117551-B | Substituted (1H-pyrazolo [3,4-b ] pyridine) urea compound and anti-tumor application thereof | 华东理工大学 | 2020-03-27 | — | — | CN | disclosed |