Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.47 |
| ▸ | GPR119 | Q8TDV5 | 3/20 | 0.47 |
| ▸ | AKR1B1 | P15121 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | NAAA | Q02083 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 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 | |
|---|---|---|---|---|
| SCHEMBL20274201 | 0.86 | EPHX2 (0.52) | HDAC6AKR1B1NPC1RAB9AEPHX2 | |
| SCHEMBL20651340 | 0.86 | HDAC6 (0.49) | HDAC6KCNH2AKR1B1TP53L3MBTL1 | |
| SCHEMBL20274125 | 0.85 | AKR1B1 (0.53) | HDAC6AKR1B1AKR1A1L3MBTL1DYRK1A | |
| SCHEMBL20274208 | 0.80 | KCNH2 (0.43) | HDAC6KCNH2GPR119AKR1B1AKR1A1 | |
| SCHEMBL20274151 | 0.79 | FAAH (0.48) | AKR1B1MAPTTP53NPC1RAB9A | |
| SCHEMBL15708163 | 0.78 | HDAC6 (0.46) | HDAC6KCNH2GPR119AKR1B1AKR1A1 | |
| SCHEMBL20274161 | 0.74 | KCNH2 (0.52) | KCNH2TP53NPC1RAB9ACYP2D6 | |
| SCHEMBL20274164 | 0.74 | KCNH2 (0.42) | KCNH2GPR119AKR1B1AKR1A1DYRK1A | |
| SCHEMBL23336086 | 0.73 | FAAH (0.57) | CYP2D6CYP2C9ALOX15TSHRCYP2C19 | |
| SCHEMBL20964520 | 0.71 | AKR1B1 (0.52) | HDAC6AKR1B1AKR1A1L3MBTL1DYRK1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3428162-B1 | ANTHELMINTIC COMPOUNDS AND COMPOSITIONS AND METHOD OF USING THEREOF | BOEHRINGER INGELHEIM ANIMAL HEALTH USA INC (US) | 2021-05-05 | — | — | EP | disclosed |
| EP-2922845-B1 | ANTHELMINTIC COMPOUNDS AND COMPOSITIONS AND METHOD OF USING THEREOF | MERIAL INC (US) | 2018-06-20 | — | — | EP | disclosed |