Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.53 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.50 |
| ▸ | KYNU | Q16719 | 1/20 | 0.49 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | HPGDS | O60760 | 2/20 | 0.46 |
| ▸ | NOS2 | P35228 | 1/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.45 |
| ▸ | ALPI | P09923 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | XIAP | P98170 | 1/20 | 0.44 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | CPA1 | P15085 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | CPN1 | P15169 | 1/20 | 0.44 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL11019097 | 0.87 | EPHX1 (0.73) | EPHX1KYNUGRIA2HPGDSOPRK1 | |
| SCHEMBL599399 | 0.84 | EPHX1 (0.71) | EPHX1P4HTMCYP1A2ALPIPKM | |
| SCHEMBL3079795 | 0.84 | EPHX1 (0.71) | EPHX1P4HTMCYP1A2ALPIPKM | |
| SCHEMBL67234 | 0.84 | EPHX1 (0.71) | EPHX1P4HTMCYP1A2ALPIPKM | |
| Hydrochloric Acid SCHEMBL933353 | 0.82 | EPHX1 (0.69) | EPHX1P4HTMCYP1A2ALPIPKM | |
| SCHEMBL11143478 | 0.82 | EPHX1 (0.51) | EPHX1P4HTMCYP1A2ALPIPKM | |
| SCHEMBL8869646 | 0.82 | MEN1 (0.64) | EPHX1P4HTMCYP1A2LMNA | |
| SCHEMBL186896 | 0.82 | EPHX1 (0.51) | EPHX1P4HTMCYP1A2ALPIPKM | |
| SCHEMBL28116858 | 0.81 | GRIA2 (0.45) | EPHX1KYNUGRIA2CYP1A2PKM | |
| SCHEMBL5156210 | 0.81 | ESR1 (0.61) | EPHX1P4HTMCYP1A2ALPIPKM |
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 |
|---|---|---|---|---|---|---|---|
| CN-105330630-B | Benzofuran compounds and its preparation method and application | 上海交通大学 | 2018-04-17 | — | — | CN | disclosed |
| EP-1957495-A1 | FUSED HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2008-08-20 | — | — | EP | disclosed |
| WO-2007064045-A1 | FUSED HETEROCYCLIC COMPOUND | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2007-06-07 | — | — | WO | disclosed |