Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.40 |
| ▸ | KDM4A | O75164 | 2/20 | 0.38 |
| ▸ | KDM5C | P41229 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | KDM6B | O15054 | 1/20 | 0.38 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.38 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11516114 | 0.81 | ALDH1A1 (0.46) | ALDH1A1TDP1MEN1KMT2ACYP1A2 | |
| SCHEMBL6129995 | 0.80 | ALDH1A1 (0.52) | ALDH1A1TDP1MEN1KMT2ACYP1A2 | |
| SCHEMBL13610488 | 0.78 | TDP1 (0.43) | ALDH1A1TDP1MEN1KMT2ACYP1A2 | |
| SCHEMBL6129993 | 0.77 | ALDH1A1 (0.45) | ALDH1A1TDP1MEN1KMT2ACYP1A2 | |
| SCHEMBL8834668 | 0.75 | ALDH1A1 (0.41) | ALDH1A1TDP1MEN1KMT2ACYP1A2 | |
| SCHEMBL1521573 | 0.73 | HSP90AA1 (0.43) | CYP1A2CYP2D6ADORA3KDM4ECYP3A4 | |
| SCHEMBL11184781 | 0.73 | MAPK1 (0.48) | ALDH1A1TDP1MEN1KMT2ACYP1A2 | |
| SCHEMBL4580145 | 0.72 | ALDH1A1 (0.38) | ALDH1A1TDP1MEN1KMT2ACYP1A2 | |
| SCHEMBL30665030 | 0.71 | ALDH1A1 (0.46) | ALDH1A1TDP1MEN1KMT2ACYP1A2 | |
| SCHEMBL4226888 | 0.71 | ALDH1A1 (0.46) | ALDH1A1TDP1MEN1KMT2ACYP1A2 |
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-6008224-A | POTENT ENDOTHELIN ANTAGONISM TREATING VASOCONSTRICTIVE EFFECT AND CELL PROLIFERATION EFFECT | KOWA CO., LTD. (JP) | 1999-12-28 | — | — | US | claimed |
| US-20180132503-A1 | PROCESS FOR PRODUCING A LIQUID EXTRACT, PROCESS FOR PRODUCING COFFEE WITH REDUCED BITTERNESS, PROCESS FOR PRODUCING TEA, AND PROCESS FOR PRODUCING A LIQUID EXTRACT WHICH INCLUDES PYRAZINES | THE COCA-COLA COMPANY | 2018-05-17 | — | — | US | disclosed |
| EP-3297450-A1 | PROCESS FOR PRODUCING A LIQUID EXTRACT, PROCESS FOR PRODUCING COFFEE WITH REDUCED BITTERNESS, PROCESS FOR PRODUCING TEA, AND PROCESS FOR PRODUCING A LIQUID EXTRACT WHICH INCLUDE PYRAZINES | The Coca-Cola Company (US) | 2018-03-28 | — | — | EP | disclosed |
| WO-2016186686-A1 | PROCESS FOR PRODUCING A LIQUID EXTRACT, PROCESS FOR PRODUCING COFFEE WITH REDUCED BITTERNESS, PROCESS FOR PRODUCING TEA, AND PROCESS FOR PRODUCING A LIQUID EXTRACT WHICH INCLUDE PYRAZINES | THE COCA-COLA COMPANY (US) | 2016-11-24 | — | — | WO | disclosed |