Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29883661 | 1.00 | CYP2C9 (0.51) | CYP2C9PTGS1PTGS2HPGDCYP2C19 | |
| SCHEMBL28301536 | 0.84 | CYP2C9 (0.52) | CYP2C9PTGS1PTGS2HPGDCYP2C19 | |
| SCHEMBL28577714 | 0.83 | DNMT1 (0.46) | CYP2C9PTGS1PTGS2HPGDKDM4E | |
| SCHEMBL22639071 | 0.76 | NPC1 (0.39) | CYP2C9HPGDKDM4ESMN1; SMN2MEN1 | |
| SCHEMBL6753122 | 0.75 | CYP2C9 (0.50) | CYP2C9HPGDCYP2C19KDM4ESMN1; SMN2 | |
| SCHEMBL28506677 | 0.74 | HPGD (0.39) | CYP2C9HPGDKDM4ESMN1; SMN2MEN1 | |
| SCHEMBL6698405 | 0.73 | CYP17A1 (0.44) | KDM4ESMN1; SMN2MEN1KMT2AHDAC1 | |
| Benzene SCHEMBL28280478 | 0.73 | CES2 (0.44) | ALOX15 | |
| SCHEMBL28299745 | 0.72 | CYP2C9 (0.50) | CYP2C9HPGDCYP2C19KDM4CSMN1; SMN2 | |
| SCHEMBL28355672 | 0.71 | CES2 (0.45) | KDM4ESMN1; SMN2ALOX15 |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112858534-B | HPLC detection method for baroxavir ester intermediate and related substances thereof | 山东新华制药股份有限公司 | 2022-09-27 | — | — | CN | claimed |
| CN-110790690-A | Synthetic method of 3, 4-difluoro-2- ((phenylthio) methyl) benzoic acid | 湖南师范大学 | 2020-02-14 | — | — | CN | claimed |
| CN-109721585-A | A kind of preparation method of Ba Luoshawei key intermediate | 浙江工业大学 | 2019-05-07 | — | — | CN | claimed |
| CN-112858534-B | HPLC detection method for baroxavir ester intermediate and related substances thereof | 山东新华制药股份有限公司 | 2022-09-27 | — | — | CN | disclosed |
| CN-112062750-B | Process for preparing a Barosavir intermediate and intermediate obtained by this process | 和鼎（南京）医药技术有限公司 | 2021-07-20 | — | — | CN | disclosed |
| CN-109504721-B | Synthetic method of anti-influenza medicine | 杭州科巢生物科技有限公司 | 2021-07-09 | — | — | CN | disclosed |
| CN-112858534-A | HPLC detection method for baroxavir ester intermediate and related substances thereof | 山东新华制药股份有限公司 | 2021-05-28 | — | — | CN | disclosed |
| CN-110143941-B | Synthesis method of intermediate of balusavir mefene | 北京四环制药有限公司 | 2021-05-25 | — | — | CN | disclosed |
| CN-112062750-A | Process for preparing a Barosavir intermediate and intermediate obtained by this process | 和鼎（南京）医药技术有限公司 | 2020-12-11 | — | — | CN | disclosed |
| CN-110790690-A | Synthetic method of 3, 4-difluoro-2- ((phenylthio) methyl) benzoic acid | 湖南师范大学 | 2020-02-14 | — | — | CN | disclosed |
| CN-110790690-A | Synthetic method of 3, 4-difluoro-2- ((phenylthio) methyl) benzoic acid | 湖南师范大学 | 2020-02-14 | — | — | CN | disclosed |
| CN-109721585-A | A kind of preparation method of Ba Luoshawei key intermediate | 浙江工业大学 | 2019-05-07 | — | — | CN | disclosed |