Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.36 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.36 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.33 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9868772 | 0.76 | ALOX5 (0.46) | BRAFKDM4EALDH1A1GLAGAA | |
| SCHEMBL9869116 | 0.76 | KDM4E (0.43) | KDM4EALDH1A1GAAHPGD | |
| SCHEMBL657642 | 0.71 | BRAF (0.42) | BRAFKDM4EALDH1A1GLAGAA | |
| SCHEMBL9868855 | 0.71 | ALOX5 (0.45) | BRAFKDM4EALDH1A1GLAGAA | |
| SCHEMBL5620698 | 0.71 | ALDH1A1 (0.46) | BRAFKDM4EALDH1A1GLAGAA | |
| SCHEMBL9869316 | 0.70 | LMNA (0.40) | KDM4ENCOA3 | |
| SCHEMBL9869324 | 0.69 | HSPA5 (0.31) | — | |
| SCHEMBL9870113 | 0.66 | CNR1 (0.45) | KDM4EALDH1A1GLAGAAHPGD | |
| SCHEMBL9869497 | 0.66 | ALOX5 (0.46) | KDM4EGAAHTTHSD17B10ALOX5 | |
| SCHEMBL10691956 | 0.64 | KDM4E (0.39) | BRAFKDM4EALDH1A1HPGDHTT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5026941-A | Catalytic alkylation of naphthalene and/or 2-isopropyl-naphthalene in the presence of a saturated polycarbocyclic compound to yield 2,6- and 2,7-diisopropylnaphthalene | TOSHO CORPORATION (JP) | 1991-06-25 | — | — | US | disclosed |
| US-5006532-A | Enzyme inhibitor; antiinflammatory agents | MERCK & CO. INC., INC. (US) | 1991-04-09 | — | — | US | disclosed |
| US-4904672-A | Derivatives of 3-hydroxyazabenzo[b]thiophene useful as 5-lipoxygenase inhibitors | MERCK & CO., INC. (US) | 1990-02-27 | — | — | US | disclosed |
| US-4767766-A | Derivatives of 3-hydroxyazabenzo(B)thiophene useful as 5-lipoxygenase inhibitors | MERCK & CO., INC. (US) | 1988-08-30 | — | — | US | disclosed |