Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.40 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | AR | P10275 | 1/20 | 0.38 |
| ▸ | GRM5 | P41594 | 2/20 | 0.38 |
| ▸ | FBP1 | P09467 | 1/20 | 0.37 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.36 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.36 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.36 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28151649 | 0.92 | L3MBTL1 (0.41) | L3MBTL1MEN1KMT2AFFAR1NAPRT | |
| Formamide SCHEMBL28205622 | 0.89 | L3MBTL1 (0.39) | L3MBTL1MEN1KMT2AFFAR1NAPRT | |
| SCHEMBL30212370 | 0.88 | — | — | |
| SCHEMBL75830 | 0.88 | — | — | |
| Methane SCHEMBL27716533 | 0.84 | L3MBTL1 (0.43) | L3MBTL1MEN1KMT2AFFAR1NAPRT | |
| Methylene Chloride SCHEMBL27716532 | 0.82 | CHRNB2 (0.45) | L3MBTL1MEN1KMT2AFFAR1TMPRSS4 | |
| SCHEMBL2012814 | 0.79 | GRM5 (0.49) | L3MBTL1MEN1KMT2AKDM4EALDH1A1 | |
| Formic Acid SCHEMBL27735467 | 0.75 | CA2 (0.57) | ALDH1A1FBP1TSHRCA12CA2 | |
| Formic Acid SCHEMBL28844167 | 0.74 | NAPRT (0.47) | L3MBTL1MEN1KMT2ANAPRTALDH1A1 | |
| SCHEMBL1744144 | 0.73 | PIK3CD (0.52) | ARCYP11B2CA12CA2CA9 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106117193-B | New Hete rocyclic derivatives and its application in neurogenic disease treatment | 诺华股份有限公司 | 2019-09-13 | — | — | CN | disclosed |
| CN-104066727-B | Methyl fluoride -5,6- dihydro -4H- [1,3] oxazines class | 霍夫曼-拉罗奇有限公司 | 2019-04-26 | — | — | CN | disclosed |
| CN-106795177-B | BACE1 inhibitors | 豪夫迈·罗氏有限公司 | 2019-04-23 | — | — | CN | disclosed |
| CN-108690052-A | 5- aryl -1- imino group -1- oxos-[1,2,4]Thiadiazine | 豪夫迈·罗氏有限公司 | 2018-10-23 | — | — | CN | disclosed |
| CN-105683199-B | 5-aryl-1-imino-1-oxo- [1, 2, 4] thiadiazines | 豪夫迈·罗氏有限公司 | 2018-06-26 | — | — | CN | disclosed |
| CN-106795177-A | BACE1 inhibitors | 豪夫迈·罗氏有限公司 | 2017-05-31 | — | — | CN | disclosed |
| CN-105683199-A | 5-aryl-1-imino-1-oxo- [1,2,4] thiadiazines | 豪夫迈·罗氏有限公司 | 2016-06-15 | — | — | CN | disclosed |