Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 2/20 | 0.46 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.44 |
| ▸ | GRIK2 | Q13002 | 1/20 | 0.44 |
| ▸ | MMP12 | P39900 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.43 |
| ▸ | ITGAV | P06756 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.42 |
| ▸ | SUCNR1 | Q9BXA5 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | SLC7A5 | Q01650 | 2/20 | 0.40 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL5371011 | 1.00 | EPHX1 (0.46) | EPHX1GRIK1GRIK2MMP12EPHX2 | |
| SCHEMBL28114756 | 0.87 | EPHX1 (0.46) | EPHX1GRIK1GRIK2MMP12EPHX2 | |
| Hydrochloric Acid SCHEMBL16563786 | 0.86 | EPHX1 (0.45) | EPHX1GRIK1GRIK2MMP12EPHX2 | |
| SCHEMBL27582399 | 0.84 | KMT2A (0.43) | ALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL29178245 | 0.83 | FNTA (0.47) | EPHX1MMP12EPHX2ALDH1A1KMT2A | |
| SCHEMBL7169484 | 0.83 | ALDH1A1 (0.46) | EPHX1EPHX2ALDH1A1KMT2ASMN1; SMN2 | |
| SCHEMBL20545894 | 0.82 | CTSA (0.52) | EPHX1MMP12KMT2ASMN1; SMN2SUCNR1 | |
| SCHEMBL20545896 | 0.82 | CTSA (0.52) | EPHX1MMP12KMT2ASMN1; SMN2SUCNR1 | |
| SCHEMBL20764626 | 0.82 | KMT2A (0.61) | EPHX1MMP12KMT2ASMN1; SMN2 | |
| SCHEMBL30412148 | 0.82 | KMT2A (0.61) | EPHX1MMP12KMT2ASMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6645939-B1 | Very late antigen-4 (VLA) integrin antagonists; antiallergens, antiasthmatics, and antiinflammatory agents; multiple sclerosis, autoimmune disease treatment | MERCK & CO., INC. | 2003-11-11 | — | — | US | disclosed |