Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | IL2 | P60568 | 1/20 | 0.34 |
| ▸ | FEN1 | P39748 | 4/20 | 0.33 |
| ▸ | ALOX5AP | P20292 | 3/20 | 0.33 |
| ▸ | VRK1 | Q99986 | 1/20 | 0.33 |
| ▸ | STIM1 | Q13586 | 3/20 | 0.32 |
| ▸ | ORAI1 | Q96D31 | 3/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.32 |
| ▸ | MBNL1 | Q9NR56 | 1/20 | 0.31 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.31 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | CASP3 | P42574 | 1/20 | 0.31 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21061329 | 0.90 | IL2 (0.35) | CYP2A6IL2FEN1ALOX5APVRK1 | |
| SCHEMBL4416025 | 0.84 | MGAM (0.36) | FEN1ALOX5APMBNL1GRIN2BNPC1 | |
| SCHEMBL29919696 | 0.84 | MGAM (0.36) | FEN1ALOX5APMBNL1GRIN2BNPC1 | |
| SCHEMBL29432957 | 0.82 | ABCB1 (0.39) | FEN1ALOX5APMBNL1GRIN2BL3MBTL1 | |
| SCHEMBL4412921 | 0.82 | ABCB1 (0.39) | FEN1ALOX5APMBNL1GRIN2BL3MBTL1 | |
| SCHEMBL318061 | 0.82 | AKR1C3 (0.41) | CYP2A6MBNL1CYP1A2NPC1 | |
| SCHEMBL29352004 | 0.82 | AKR1C3 (0.41) | CYP2A6MBNL1CYP1A2NPC1 | |
| SCHEMBL31290758 | 0.82 | CYP2A6 (0.35) | CYP2A6IL2FEN1ALOX5APPDK2 | |
| Hydrochloric Acid SCHEMBL4531372 | 0.81 | AKR1C3 (0.41) | CYP2A6MBNL1CYP1A2NPC1 | |
| SCHEMBL4507256 | 0.80 | L3MBTL1 (0.39) | L3MBTL1CASP3SENP8SENP7SENP6 |
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-2223919-B1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUNDS AND THEIR USE AS AGRICULTURAL AND HORTICULTURAL FUNGICIDES | NIPPON SODA CO (JP) | 2014-10-15 | — | — | EP | disclosed |
| EP-2223919-A1 | NITROGEN-CONTAINING HETEROCYCLIC COMPOUND AND BACTERICIDE FOR AGRICULTURAL AND HORTICULTURAL USE | Nippon Soda Co., Ltd. (JP) | 2010-09-01 | — | — | EP | disclosed |