Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 3/20 | 0.46 |
| ▸ | NPY1R | P25929 | 1/20 | 0.40 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.40 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | SRC | P12931 | 1/20 | 0.38 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.38 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.37 |
| ▸ | MC4R | P32245 | 1/20 | 0.37 |
| ▸ | MC5R | P33032 | 1/20 | 0.37 |
| ▸ | MC3R | P41968 | 1/20 | 0.37 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.36 |
| ▸ | MAOB | P27338 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.36 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8621840 | 0.83 | DRD4 (0.49) | CHRM2CD274 | |
| SCHEMBL15591019 | 0.76 | CHRM2 (0.77) | CHRM2MAOAMAOB | |
| SCHEMBL29774090 | 0.76 | CHRM2 (0.77) | CHRM2MAOAMAOB | |
| SCHEMBL6042308 | 0.74 | HRH1 (0.52) | SRC | |
| SCHEMBL10133262 | 0.73 | TAAR1 (0.50) | SRCACHE | |
| SCHEMBL30083604 | 0.73 | TAAR1 (0.50) | SRCACHE | |
| SCHEMBL10133077 | 0.73 | GAA (0.51) | CHRM2MAOASRC | |
| SCHEMBL10483877 | 0.72 | MAOB (0.43) | CHRM2MC4RMC5RMC3RCXCR4 | |
| SCHEMBL10483888 | 0.72 | IL6 (0.41) | CHRM2MC4RMC5RMC3RCXCR4 | |
| SCHEMBL10483882 | 0.72 | CHRM2 (0.40) | CHRM2MC4RMC5RMC3RCXCR4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1613613-B1 | CXCR4 CHEMOKINE RECEPTOR BINDING COMPOUNDS | GENZYME CORP (US) | 2021-06-02 | — | — | EP | disclosed |