Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 8/20 | 0.45 |
| ▸ | KDM4A | O75164 | 1/20 | 0.44 |
| ▸ | CASP2 | P42575 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | ZDHHC20 | Q5W0Z9 | 1/20 | 0.38 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.38 |
| ▸ | NAAA | Q02083 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL139466 | 0.91 | KDM4A (0.54) | EPHX1KDM4ACASP2ALDH1A1TSHR | |
| SCHEMBL3271166 | 0.89 | KDM4A (0.52) | EPHX1KDM4ACASP2ZDHHC20ZDHHC2 | |
| SCHEMBL381501 | 0.89 | KDM4A (0.52) | EPHX1KDM4ACASP2ZDHHC20ZDHHC2 | |
| SCHEMBL29278260 | 0.89 | KDM4A (0.52) | EPHX1KDM4ACASP2ZDHHC20ZDHHC2 | |
| SCHEMBL27805156 | 0.83 | KDM4A (0.64) | EPHX1KDM4ACASP2ZDHHC20ZDHHC2 | |
| SCHEMBL28387223 | 0.82 | KDM4A (0.48) | EPHX1KDM4AALDH1A1 | |
| SCHEMBL78835 | 0.82 | EPHX1 (0.48) | EPHX1CASP2ALDH1A1TSHRZDHHC20 | |
| SCHEMBL30957958 | 0.80 | EPHX1 (0.44) | EPHX1KDM4ACASP2ZDHHC20ZDHHC2 | |
| SCHEMBL22471734 | 0.80 | EPHX1 (0.44) | EPHX1KDM4ACASP2ZDHHC20ZDHHC2 | |
| SCHEMBL28870686 | 0.80 | EPHX1 (0.44) | EPHX1KDM4ACASP2ZDHHC20ZDHHC2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4412072-A | STABILIZED WITH A PEROXIDE, SULFUR, POLYSULFIDE, METAL SULFIDE OR A HALOGEN | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1983-10-25 | — | — | US | claimed |
| EP-0042701-B1 | ISOCYANATE COMPOSITION | Takeda Chemical Industries, Ltd. (JP) | 1984-09-05 | — | — | EP | disclosed |
| US-4412072-A | STABILIZED WITH A PEROXIDE, SULFUR, POLYSULFIDE, METAL SULFIDE OR A HALOGEN | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1983-10-25 | — | — | US | disclosed |