Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 15/20 | 0.47 |
| ▸ | HTR2A | P28223 | 14/20 | 0.47 |
| ▸ | HRH1 | P35367 | 7/20 | 0.47 |
| ▸ | DRD2 | P14416 | 5/20 | 0.47 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.47 |
| ▸ | ADRA2C | P18825 | 4/20 | 0.47 |
| ▸ | DRD3 | P35462 | 4/20 | 0.47 |
| ▸ | DRD1 | P21728 | 3/20 | 0.47 |
| ▸ | HTR7 | P34969 | 3/20 | 0.47 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.43 |
| ▸ | HTR2B | P41595 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL903938 | 0.87 | HTR2C (0.59) | HTR2CHTR2AHRH1DRD2ADRA2A | |
| SCHEMBL8483725 | 0.86 | MEN1 (0.34) | HTR2CHTR2AHRH1DRD2ADRA2A | |
| SCHEMBL12693894 | 0.78 | HTR2A (0.50) | HTR2CHTR2AHRH1DRD2ADRA2A | |
| SCHEMBL19256741 | 0.72 | HTR2A (0.55) | HTR2CHTR2AHRH1DRD2ADRA2A | |
| SCHEMBL8164477 | 0.69 | HTR2A (0.51) | HTR2CHTR2AHRH1DRD2ADRA2A | |
| SCHEMBL8170396 | 0.69 | HTR2A (0.51) | HTR2CHTR2AHRH1DRD2ADRA2A | |
| SCHEMBL10068226 | 0.67 | HRH2 (0.42) | HTR2CHTR2AHRH1DRD2ADRA2A | |
| SCHEMBL15206684 | 0.67 | HRH2 (0.42) | HTR2CHTR2AHRH1DRD2ADRA2A | |
| SCHEMBL10068044 | 0.67 | HRH2 (0.42) | HTR2CHTR2AHRH1DRD2ADRA2A | |
| SCHEMBL15206685 | 0.67 | HRH2 (0.42) | HTR2CHTR2AHRH1DRD2ADRA2A |
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-2154134-B1 | Process for the preparation of trans-5-chloro-2-methyl-2,3,3a,12b-tetrahydro-1h-dibenz[2,3:6,7]oxepino[4,5-c]pyrrole. | MSD OSS BV (NL) | 2012-10-24 | — | — | EP | disclosed |