Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2B | P41595 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CCR5 | P51681 | 1/20 | 0.39 |
| ▸ | MGLL | Q99685 | 2/20 | 0.38 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.38 |
| ▸ | HCRTR1 | O43613 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.37 |
| ▸ | FAP | Q12884 | 1/20 | 0.37 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.37 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.37 |
| ▸ | SCD | O00767 | 2/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.36 |
| ▸ | RBP4 | P02753 | 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 | |
|---|---|---|---|---|
| SCHEMBL2931383 | 0.82 | HCRTR1 (0.48) | HCRTR2HCRTR1GAA | |
| SCHEMBL3411961 | 0.81 | CYP2C9 (0.41) | HTR2BCYP2C9CYP2C19MAPK14MAPT | |
| SCHEMBL13538909 | 0.81 | HCRTR1 (0.41) | HTR2BCCR5HCRTR2HCRTR1LMNA | |
| SCHEMBL2925299 | 0.80 | CDK4 (0.36) | HCRTR2HCRTR1 | |
| SCHEMBL3415880 | 0.80 | CDK4 (0.36) | HCRTR2HCRTR1 | |
| SCHEMBL2930629 | 0.80 | RORB (0.46) | HCRTR2HCRTR1 | |
| SCHEMBL2930541 | 0.79 | HCRTR1 (0.46) | HCRTR2HCRTR1 | |
| SCHEMBL3412984 | 0.79 | HTT (0.46) | CYP2C9CYP2C19MAPK14HCRTR2HCRTR1 | |
| SCHEMBL3415643 | 0.79 | HCRTR1 (0.46) | HCRTR2HCRTR1 | |
| SCHEMBL3415834 | 0.79 | HCRTR1 (0.46) | HCRTR2HCRTR1HTR2C |
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-2185512-B1 | TRANS-3-AZA-BICYCLO[3.1.0]HEXANE DERIVATIVES | ACTELION PHARMACEUTICALS LTD (CH) | 2010-12-29 | — | — | EP | disclosed |