Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | CCR2 | P41597 | 4/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | ADAM17 | P78536 | 2/20 | 0.44 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.43 |
| ▸ | HTR3A | P46098 | 2/20 | 0.42 |
| ▸ | ACKR3 | P25106 | 2/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.42 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.42 |
| ▸ | CACNA1G | O43497 | 1/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8541780 | 0.85 | ALDH1A1 (0.50) | ALDH1A1CCR2HTR2CDRD3HTR3A | |
| SCHEMBL8538682 | 0.82 | DRD4 (0.54) | ALDH1A1DRD3 | |
| SCHEMBL8540442 | 0.81 | ALDH1A1 (0.53) | ALDH1A1DRD3ADAM17HTR1A | |
| SCHEMBL8591324 | 0.79 | ALDH1A1 (0.50) | ALDH1A1CCR2HTR2CDRD3HTR3A | |
| SCHEMBL8540315 | 0.79 | ALDH1A1 (0.43) | ALDH1A1CCR2HTR2CDRD3HTR3A | |
| SCHEMBL8543060 | 0.78 | ADAM17 (0.45) | ALDH1A1ADAM17 | |
| SCHEMBL8543401 | 0.77 | USP2 (0.47) | ALDH1A1ADAM17 | |
| SCHEMBL8537772 | 0.76 | ALDH1A1 (0.47) | ALDH1A1ADAM17 | |
| SCHEMBL8539128 | 0.76 | POLB (0.46) | ALDH1A1ADAM17 | |
| SCHEMBL8539332 | 0.73 | KDM4E (0.53) | ALDH1A1ADAM17 |
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-0671388-B1 | (Pyrrolidinyl)phenyl carbamates and intermediate compounds, processes for their preparation and their use as medicaments | HOECHST MARION ROUSSEL INC (US) | 1998-06-10 | — | — | EP | claimed |