Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | DRD4 | P21917 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HRH1 | P35367 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | FAAH | O00519 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.34 |
| ▸ | BCHE | P06276 | 2/20 | 0.34 |
| ▸ | ACHE | P22303 | 2/20 | 0.34 |
| ▸ | EP300 | Q09472 | 2/20 | 0.34 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7276144 | 0.92 | EP300 (0.37) | HTR1ADRD4HTR2AHRH1OPRM1 | |
| SCHEMBL7285879 | 0.88 | BCHE (0.33) | HTR1ADRD4HTR2AHRH1OPRM1 | |
| SCHEMBL7338546 | 0.87 | ITGB3 (0.39) | OPRM1ALDH1A1TSHRSMN1; SMN2KCNH2 | |
| SCHEMBL7275504 | 0.86 | ABCB1 (0.45) | HTR1ADRD4HTR2AHRH1OPRM1 | |
| SCHEMBL7276469 | 0.86 | ABCB1 (0.45) | HTR1ADRD4HTR2AHRH1OPRM1 | |
| SCHEMBL7276043 | 0.85 | EP300 (0.39) | HTR1ADRD4HTR2AHRH1OPRM1 | |
| SCHEMBL7273402 | 0.84 | ABCB1 (0.44) | HTR1ADRD4HTR2AHRH1OPRM1 | |
| SCHEMBL7273518 | 0.81 | ABCB1 (0.46) | HTR1ADRD4HTR2AHRH1OPRM1 | |
| SCHEMBL7274473 | 0.81 | HTR1A (0.37) | HTR1ADRD4HTR2AHRH1OPRM1 | |
| SCHEMBL7280953 | 0.81 | HRH3 (0.40) | HTR1ADRD4HTR2AHRH1OPRM1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0528369-B1 | Cyclic imino derivatives, pharmaceutical compositions containing them and process for their preparation | BOEHRINGER INGELHEIM PHARMA (DE) | 1999-11-24 | — | — | EP | disclosed |
| US-5455348-A | Anticoagulants | Thomae, Karl (DE) | 1995-10-03 | — | — | US | disclosed |
| EP-0528369-A2 | Cyclic imino derivatives, pharmaceutical compositions containing them and process for their preparation | Dr. Karl Thomae GmbH (DE) | 1993-02-24 | — | — | EP | disclosed |