Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 2/20 | 0.54 |
| ▸ | CES1 | P23141 | 2/20 | 0.54 |
| ▸ | ALB | P02768 | 1/20 | 0.45 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.44 |
| ▸ | ICAM1 | P05362 | 1/20 | 0.44 |
| ▸ | ITGAL | P20701 | 1/20 | 0.44 |
| ▸ | CA12 | O43570 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.43 |
| ▸ | CA2 | P00918 | 2/20 | 0.43 |
| ▸ | CA7 | P43166 | 2/20 | 0.43 |
| ▸ | CA9 | Q16790 | 2/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | TTR | P02766 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL260553 | 0.89 | CES2 (0.67) | CES2CES1ALBCA12CA1 | |
| SCHEMBL27763941 | 0.87 | CES2 (0.54) | CES2CES1ALBCA12CA1 | |
| SCHEMBL3117223 | 0.86 | CES2 (0.64) | CES2CES1ALBCA12CA1 | |
| Hydrochloric Acid SCHEMBL7968059 | 0.86 | CES2 (0.64) | CES2CES1ALBCA12CA1 | |
| Propene SCHEMBL27785695 | 0.81 | CES2 (0.52) | CES2CES1ALBCA12CA1 | |
| Formic Acid SCHEMBL28286083 | 0.80 | CES2 (0.56) | CES2CES1ALBCA12CA1 | |
| Biphenyl SCHEMBL2831439 | 0.80 | CES2 (0.56) | CES2CES1ALBCA12CA1 | |
| SCHEMBL31690439 | 0.79 | KMT2A (0.56) | CES2CES1ALBCA12CA1 | |
| SCHEMBL8156294 | 0.79 | KMT2A (0.56) | CES2CES1ALBCA12CA1 | |
| SCHEMBL10950165 | 0.79 | ALB (0.52) | CES2CES1ALBITGB2ICAM1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008100202-A1 | A 2-F LUOROBENZOATE SALT AND A 2, 6-DIF LUOROBENZOATE SALT OF N-{5-CHLORO-2- [ ( (2S) -3-{ [1- (4-CHLOROBENZYL)PIPERIDIN-4- YL ] AMINO } - 2 - HYDROXY- 2 -ME T HYLPR OPYL ) OXY] - 4 - HYDROXYPHENYL } ACETAMIDE | ASTRAZENECA AB (SE) | 2008-08-21 | — | — | WO | claimed |
| WO-2008100202-A1 | A 2-F LUOROBENZOATE SALT AND A 2, 6-DIF LUOROBENZOATE SALT OF N-{5-CHLORO-2- [ ( (2S) -3-{ [1- (4-CHLOROBENZYL)PIPERIDIN-4- YL ] AMINO } - 2 - HYDROXY- 2 -ME T HYLPR OPYL ) OXY] - 4 - HYDROXYPHENYL } ACETAMIDE | ASTRAZENECA AB (SE) | 2008-08-21 | — | — | WO | disclosed |