Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.77 |
| ▸ | POLB | P06746 | 2/20 | 0.77 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.72 |
| ▸ | CES1 | P23141 | 2/20 | 0.72 |
| ▸ | CES2 | O00748 | 1/20 | 0.72 |
| ▸ | LMNA | P02545 | 2/20 | 0.65 |
| ▸ | GAA | P10253 | 1/20 | 0.65 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.63 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.62 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.62 |
| ▸ | MAPT | P10636 | 1/20 | 0.62 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | NPC1 | O15118 | 1/20 | 0.57 |
| ▸ | MITF | O75030 | 1/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | CA1 | P00915 | 2/20 | 0.57 |
| ▸ | CA2 | P00918 | 2/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| Ethane SCHEMBL28237274 | 0.96 | MAPK1 (0.77) | MAPK1POLBSRD5A2CES1CES2 | |
| SCHEMBL229627 | 0.96 | POLB (0.82) | MAPK1POLBSRD5A2CES1CES2 | |
| Benzophenone SCHEMBL28231509 | 0.96 | POLB (0.82) | MAPK1POLBSRD5A2CES1CES2 | |
| Acetic Acid SCHEMBL27610374 | 0.94 | MAPK1 (0.74) | MAPK1POLBSRD5A2CES1CES2 | |
| Acetone SCHEMBL27736525 | 0.94 | MAPK1 (0.74) | MAPK1POLBSRD5A2CES1CES2 | |
| Chloromethane SCHEMBL28092918 | 0.94 | MAPK1 (0.74) | MAPK1POLBSRD5A2CES1CES2 | |
| Methane SCHEMBL29286698 | 0.94 | POLB (0.79) | MAPK1POLBSRD5A2CES1CES2 | |
| Hydrogen Sulfide SCHEMBL28154722 | 0.94 | POLB (0.79) | MAPK1POLBSRD5A2CES1CES2 | |
| Methane SCHEMBL27439754 | 0.94 | POLB (0.79) | MAPK1POLBSRD5A2CES1CES2 | |
| Phosphine SCHEMBL28037976 | 0.94 | POLB (0.79) | MAPK1POLBSRD5A2CES1CES2 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108912171-A | The synthetic method of 4- dimethylamino benzoyl diphenyl phosphine oxide or 4- di-n-hexyl amino benzoyl diphenyl phosphine oxide | 苏州大学 | 2018-11-30 | — | — | CN | disclosed |
| CN-108697714-A | Novel fused pyrimidine compound or its salt | 大鹏药品工业株式会社 | 2018-10-23 | — | — | CN | disclosed |
| CN-108690075-A | The synthetic method of benzoyl diphenyl phosphine oxide derivative | 苏州大学 | 2018-10-23 | — | — | CN | disclosed |
| CN-106496268-B | Phosphonyl-substituted methanol derivative and preparation method and application thereof | 苏州大学 | 2018-08-24 | — | — | CN | disclosed |
| CN-107438595-A | Crystal formation and preparation method thereof | 大元制药株式会社 | 2017-12-05 | — | — | CN | disclosed |
| CN-104447730-B | Oxazolidinone compounds and its application in medicine | 广东东阳光药业有限公司 | 2017-11-07 | — | — | CN | disclosed |
| CN-106496268-A | Phosphonyl-substituted methanol derivative and preparation method and application thereof | 苏州大学 | 2017-03-15 | — | — | CN | disclosed |
| CN-106336413-A | Compounds used as JAK inhibitor, and use of compounds | 广东东阳光药业有限公司 | 2017-01-18 | — | — | CN | disclosed |
| CN-106257976-A | Human plasma kallikrein inhibitors | 拜奥克里斯特制药公司 | 2016-12-28 | — | — | CN | disclosed |