Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB2 | P05107 | 10/20 | 0.57 |
| ▸ | ICAM1 | P05362 | 10/20 | 0.57 |
| ▸ | ITGAL | P20701 | 10/20 | 0.57 |
| ▸ | ECE1 | P42892 | 2/20 | 0.46 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.46 |
| ▸ | ACE | P12821 | 1/20 | 0.45 |
| ▸ | GOT1 | P17174 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5155569 | 0.80 | ITGB2 (0.54) | ITGB2ICAM1ITGALECE1ALDH1A1 | |
| SCHEMBL5149333 | 0.80 | CDK4 (0.53) | ITGB2ICAM1ITGALERAP2HDAC3 | |
| SCHEMBL5155561 | 0.79 | HPGDS (0.54) | ITGB2ICAM1ITGALECE1ERAP2 | |
| SCHEMBL15145333 | 0.79 | ITGB2 (0.56) | ITGB2ICAM1ITGALECE1ERAP2 | |
| SCHEMBL13902824 | 0.79 | MEN1 (0.61) | ITGB2ICAM1ITGALECE1ERAP2 | |
| SCHEMBL4602371 | 0.78 | ITGB2 (0.56) | ITGB2ICAM1ITGALECE1HDAC3 | |
| SCHEMBL19412127 | 0.77 | SMN1; SMN2 (0.59) | ITGB2ICAM1ITGALECE1ACE | |
| SCHEMBL19412126 | 0.77 | SMN1; SMN2 (0.59) | ITGB2ICAM1ITGALECE1ACE | |
| SCHEMBL5149325 | 0.77 | ITGB2 (0.47) | ITGB2ICAM1ITGALERAP2HDAC3 | |
| SCHEMBL5154756 | 0.77 | ITGB2 (0.47) | ITGB2ICAM1ITGALERAP2ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1912970-A2 | ACYLTRYPTOPHANOLS FOR FERTILITY CONTROL | Bayer Schering Pharma Aktiengesellschaft (DE) | 2008-04-23 | — | — | EP | disclosed |
| WO-2007017289-A2 | ACYLTRYPTOPHANOLS FOR FERTILITY CONTROL | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2007-02-15 | — | — | WO | disclosed |