Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGR | P06401 | 1/20 | 0.51 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.51 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.51 |
| ▸ | HTR2A | P28223 | 1/20 | 0.51 |
| ▸ | HRH1 | P35367 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.51 |
| ▸ | ELANE | P08246 | 1/20 | 0.49 |
| ▸ | CTRC | Q99895 | 1/20 | 0.49 |
| ▸ | CES2 | O00748 | 4/20 | 0.49 |
| ▸ | CES1 | P23141 | 4/20 | 0.49 |
| ▸ | PRSS1 | P07477 | 3/20 | 0.48 |
| ▸ | CTSG | P08311 | 3/20 | 0.48 |
| ▸ | CTRB1 | P17538 | 3/20 | 0.48 |
| ▸ | CMA1 | P23946 | 3/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CNR2 | P34972 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL4994418 | 1.00 | PGR (0.51) | PGRADRA2AADRA2BHTR2AHRH1 | |
| SCHEMBL6424289 | 0.95 | CES2 (0.50) | PGRADRA2AADRA2BHTR2AHRH1 | |
| SCHEMBL6683969 | 0.93 | CES2 (0.51) | PGRADRA2AADRA2BHTR2AHRH1 | |
| SCHEMBL6684015 | 0.93 | CES2 (0.51) | PGRADRA2AADRA2BHTR2AHRH1 | |
| SCHEMBL6686403 | 0.93 | CES2 (0.51) | PGRADRA2AADRA2BHTR2AHRH1 | |
| SCHEMBL8901194 | 0.93 | CES2 (0.51) | PGRADRA2AADRA2BHTR2AHRH1 | |
| SCHEMBL1195165 | 0.93 | CES2 (0.51) | PGRADRA2AADRA2BHTR2AHRH1 | |
| SCHEMBL15659882 | 0.93 | CES2 (0.51) | PGRADRA2AADRA2BHTR2AHRH1 | |
| SCHEMBL11170402 | 0.90 | PGR (0.52) | PGRADRA2AADRA2BHTR2AHRH1 | |
| SCHEMBL17002137 | 0.89 | PGR (0.55) | PGRADRA2AADRA2BHTR2AHRH1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0751927-A4 | SYNTHESIS OF COMPOUNDS WITH PREDETERMINED CHIRALITY | CALIFORNIA INST OF TECHN (US) | 1998-07-29 | — | — | EP | disclosed |
| EP-0751927-A1 | SYNTHESIS OF COMPOUNDS WITH PREDETERMINED CHIRALITY | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 1997-01-08 | — | — | EP | disclosed |
| US-5488131-A | Synthesis of compounds with predetermined chirality | CALIFORNIA INSTITUTE OF TECHNOLOGY | 1996-01-30 | — | — | US | disclosed |
| WO-1995025714-A1 | SYNTHESIS OF COMPOUNDS WITH PREDETERMINED CHIRALITY | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 1995-09-28 | — | — | WO | disclosed |