Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | ANPEP | P15144 | 1/20 | 0.36 |
| ▸ | LAP3 | P28838 | 1/20 | 0.36 |
| ▸ | TACR1 | P25103 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16635566 | 1.00 | HTR2A (0.40) | HTR2AHTR2CHTR2BALDH1A1TSHR | |
| SCHEMBL635649 | 0.78 | CYP2D6 (0.40) | KDM4ELMNAMAPK1TAAR1SLC6A2 | |
| SCHEMBL1167957 | 0.77 | ALDH1A1 (0.46) | HTR2AHTR2CHTR2BALDH1A1TSHR | |
| SCHEMBL1131722 | 0.77 | KDM4E (0.58) | ALDH1A1KDM4ELMNAMAPK1TAAR1 | |
| SCHEMBL4918492 | 0.77 | KDM4E (0.58) | ALDH1A1KDM4ELMNAMAPK1TAAR1 | |
| SCHEMBL1131718 | 0.77 | KDM4E (0.58) | ALDH1A1KDM4ELMNAMAPK1TAAR1 | |
| Hydrochloric Acid SCHEMBL8841082 | 0.76 | KDM4E (0.56) | ALDH1A1KDM4ELMNAMAPK1ANPEP | |
| Hydrochloric Acid SCHEMBL8841083 | 0.76 | KDM4E (0.56) | ALDH1A1KDM4ELMNAMAPK1ANPEP | |
| SCHEMBL7158095 | 0.74 | CYP2D6 (0.37) | KDM4ELMNAMAPK1TAAR1SLC6A2 | |
| SCHEMBL4521336 | 0.73 | CYP2D6 (0.53) | KDM4ELMNAMAPK1TAAR1SLC6A2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1135349-B1 | PROCESS FOR PREPARING CHIRAL COMPOUNDS | UNIV ST ANDREWS (GB) | 2005-04-06 | — | — | EP | claimed |
| US-7126028-B1 | Process for preparing chiral compounds | THE UNIVERSITY COURT OF THE UNIVERSITY OF ST. ANDREWS (GB) | 2006-10-24 | — | — | US | disclosed |
| EP-1135349-B1 | PROCESS FOR PREPARING CHIRAL COMPOUNDS | UNIV ST ANDREWS (GB) | 2005-04-06 | — | — | EP | disclosed |
| EP-1135349-A1 | PROCESS FOR PREPARING CHIRAL COMPOUNDS | UNIVERSITY OF DURHAM (GB) | 2001-09-26 | — | — | EP | disclosed |
| WO-2000034210-A1 | PROCESS FOR PREPARING CHIRAL COMPOUNDS | UNIVERSITY OF DURHAM (GB) | 2000-06-15 | — | — | WO | disclosed |