Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 3/20 | 0.36 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | PRCP | P42785 | 1/20 | 0.33 |
| ▸ | RECQL | P46063 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.32 |
| ▸ | TDO2 | P48775 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL14160348 | 0.80 | KDM4E (0.50) | ADRA2CALDH1A1MAPTPRCPRECQL | |
| SCHEMBL4782058 | 0.78 | ADRA2C (0.57) | HTR2CADRA2CALDH1A1MAPTPRCP | |
| Hydrochloric Acid SCHEMBL4780986 | 0.77 | ADRA2C (0.56) | HTR2CADRA2CALDH1A1MAPTPRCP | |
| SCHEMBL4801731 | 0.75 | HTR2C (0.36) | HTR2CADRA2CALDH1A1MAPTKDM4E | |
| SCHEMBL1267500 | 0.71 | ALDH1A1 (0.62) | HTR2CADRA2CALDH1A1MAPTPRCP | |
| SCHEMBL13170398 | 0.65 | HTR2C (0.50) | HTR2CALDH1A1PRCPHTR2AHTR2B | |
| SCHEMBL10508976 | 0.63 | DDB1 (0.45) | HTR2CALDH1A1PRCPKDM4E | |
| Hydrochloric Acid SCHEMBL34469205 | 0.63 | ATM (0.33) | ALDH1A1KDM4E | |
| Hydrochloric Acid SCHEMBL34469278 | 0.63 | ATM (0.33) | ALDH1A1KDM4E | |
| SCHEMBL23323100 | 0.62 | HTR2C (0.52) | HTR2CTAAR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008067222-A1 | HETEROCYCLIC MODULATORS OF TGR5 | KALYPSYS, INC. (US) | 2008-06-05 | — | — | WO | disclosed |