Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.42 |
| ▸ | AKT1 | P31749 | 5/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.39 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.39 |
| ▸ | SIRT3 | Q9NTG7 | 1/20 | 0.39 |
| ▸ | SNCA | P37840 | 4/20 | 0.39 |
| ▸ | ECE1 | P42892 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | THRB | P10828 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL4843500 | 1.00 | ALOX5 (0.42) | ALOX5EPHX2AKT1MEN1KMT2A | |
| SCHEMBL4803110 | 0.93 | MMP9 (0.41) | ALOX5EPHX2AKT1MEN1KMT2A | |
| SCHEMBL4738991 | 0.93 | MMP9 (0.41) | ALOX5EPHX2AKT1MEN1KMT2A | |
| SCHEMBL4633746 | 0.93 | MEN1 (0.40) | ALOX5EPHX2AKT1MEN1KMT2A | |
| SCHEMBL4736318 | 0.93 | AKT1 (0.40) | ALOX5EPHX2AKT1MEN1KMT2A | |
| SCHEMBL4735787 | 0.91 | KMT2A (0.45) | ALOX5EPHX2AKT1MEN1KMT2A | |
| SCHEMBL4634204 | 0.89 | HDAC3 (0.41) | MEN1KMT2ASNCAECE1MAPT | |
| SCHEMBL4737690 | 0.88 | AKT1 (0.47) | AKT1MEN1KMT2ASNCAECE1 | |
| SCHEMBL4737003 | 0.87 | KMT2A (0.49) | MEN1KMT2AMAPTHPGDALDH1A1 | |
| SCHEMBL13945806 | 0.87 | MMP9 (0.47) | MEN1KMT2AECE1MAPTHPGD |
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 |
|---|---|---|---|---|---|---|---|
| WO-2008071453-A1 | 1,2-DIARYLACETYLENE DERIVATIVES OF ACYLTRYPTOPHANOLS | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2008-06-19 | — | — | WO | claimed |
| WO-2008071453-A1 | 1,2-DIARYLACETYLENE DERIVATIVES OF ACYLTRYPTOPHANOLS | BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) | 2008-06-19 | — | — | WO | disclosed |