Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | CFTR | P13569 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.42 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.41 |
| ▸ | GPR27 | Q9NS67 | 1/20 | 0.41 |
| ▸ | HPD | P32754 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.40 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | ACLY | P53396 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28233849 | 0.87 | CES2 (0.46) | CES2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL27498316 | 0.85 | HSP90AB1 (0.43) | ALDH1A1HPGDHSD17B10HSP90AB1CYP2C19 | |
| SCHEMBL7786271 | 0.85 | PTPN1 (0.56) | CES2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL14054107 | 0.83 | CES2 (0.49) | CES2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL24451071 | 0.81 | HSP90AB1 (0.61) | CES2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL26056992 | 0.81 | CES2 (0.66) | CES2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL2075208 | 0.81 | GAA (0.54) | CES2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL2477164 | 0.81 | CES2 (0.50) | CES2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL30519391 | 0.81 | CES2 (0.50) | CES2KDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL5951860 | 0.80 | PDE2A (0.50) | CES2KDM4EALDH1A1HPGDHSD17B10 |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110049973-A | 1, 4-diphenyl-1H-imidazole and 2, 4-diphenyl thiazole derivatives, and preparation method and application thereof | 南方医科大学 | 2019-07-23 | — | — | CN | disclosed |
| CN-103906746-B | (4-phenylimidazol-2-yl) ethylamine derivatives as sodium channel modulators | PFIZER LTD. (GB) | 2015-12-09 | — | — | CN | disclosed |
| CN-103221047-A | Compounds and methods | TEMPERO PHARMACEUTICALS INC | 2013-07-24 | — | — | CN | disclosed |
| CN-102947300-A | Alkaloid aminoester derivatives and medicinal compositions thereof | CHIESI FARMA SPA | 2013-02-27 | — | — | CN | disclosed |
| CN-102838546-A | Pyrazole derivatives as modulators of 5-ht2a serotonin receptor useful for treatment of disorders related thereto | ARENA PHARM INC | 2012-12-26 | — | — | CN | disclosed |
| CN-101611013-B | As 5-HT2APyrazole derivatives of serotonin receptor modulators for the treatment of disorders related thereto | ARENA PHARM INC | 2012-09-05 | — | — | CN | disclosed |
| CN-102516192-A | Antagonists of the vanilloid receptor subtype 1 (VR1) and uses thereof | ABBOTT LAB | 2012-06-27 | — | — | CN | disclosed |
| CN-102307852-A | Cyclic amine compounds | DAIICHI SANKYO CO LTD | 2012-01-04 | — | — | CN | disclosed |
| CN-102307847-A | Indanyl compounds | DAIICHI SANKYO CO LTD | 2012-01-04 | — | — | CN | disclosed |
| CN-101611013-A | As 5-HT2APyrazole derivatives of serotonin receptor modulators for the treatment of disorders related thereto | ARENA PHARM INC (US) | 2009-12-23 | — | — | CN | disclosed |
| CN-101360743-A | Polycyclic 1,2,3, 4-tetrahydro-isoquinoline derivatives and compositions containing them as PPAR modulators | IRM LLC (VG) | 2009-02-04 | — | — | CN | disclosed |
| CN-101248052-A | Vanilloid receptor subtype 1(VR1) antagonists and uses thereof | ABBOTT LAB (US) | 2008-08-20 | — | — | CN | disclosed |