Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.52 |
| ▸ | CA2 | P00918 | 3/20 | 0.52 |
| ▸ | CA7 | P43166 | 2/20 | 0.52 |
| ▸ | CA9 | Q16790 | 2/20 | 0.52 |
| ▸ | CA12 | O43570 | 1/20 | 0.52 |
| ▸ | CA4 | P22748 | 1/20 | 0.52 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.40 |
| ▸ | ORAI1 | Q96D31 | 1/20 | 0.39 |
| ▸ | ORAI2 | Q96SN7 | 1/20 | 0.39 |
| ▸ | ORAI3 | Q9BRQ5 | 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 | |
|---|---|---|---|---|
| SCHEMBL7 | 0.91 | — | — | |
| SCHEMBL27974932 | 0.88 | CA1 (0.60) | CA1CA2CA7CA9CA12 | |
| SCHEMBL27974734 | 0.88 | CA1 (0.60) | CA1CA2CA7CA9CA12 | |
| SCHEMBL27583390 | 0.88 | CA1 (0.60) | CA1CA2CA7CA9CA12 | |
| Magnesium Chloride Anhydrous SCHEMBL27559518 | 0.86 | CA1 (0.52) | CA1CA2CA7CA9CA12 | |
| SCHEMBL27841172 | 0.86 | CA1 (0.52) | CA1CA2CA7CA9CA12 | |
| SCHEMBL27641055 | 0.82 | CA1 (0.52) | CA1CA2CA7CA9CA12 | |
| Acetic Acid SCHEMBL27619403 | 0.78 | CA1 (0.50) | CA1CA2CA7CA9CA12 | |
| SCHEMBL28284679 | 0.78 | NFE2L2 (0.48) | CA1CA2CA7CA9CA12 | |
| SCHEMBL5547842 | 0.77 | CA1 (0.59) | CA1CA2CA7CA9CA12 |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105814022-B | Condensed bicyclic heteroaromatic derivative as TNF active regulators | UCB生物制药私人有限公司 | 2018-09-28 | — | — | CN | disclosed |
| CN-104781250-B | New antibacterial compounds | 爱尔兰詹森科学公司 | 2017-05-10 | — | — | CN | disclosed |
| CN-105814022-A | Fused bicyclic heteroaromatic derivatives as modulators of tnf activity | UCB生物制药私人有限公司 | 2016-07-27 | — | — | CN | disclosed |
| CN-105503869-A | Antibacterial piperidinyl substituted 3,4-dihydro-1H-[1,8]naphthyridinones | JANSSEN R & D IRELAND | 2016-04-20 | — | — | CN | disclosed |
| CN-103917540-B | Antibacterial piperidinyl-substituted 3, 4-dihydro-1H- [1, 8] naphthyridinones | JANSSEN R&D IRELAND (IE) | 2016-03-16 | — | — | CN | disclosed |
| CN-104903300-A | Comt inhibitors | HOFFMANN LA ROCHE | 2015-09-09 | — | — | CN | disclosed |
| CN-104781250-A | New antibacterial compounds | JANSSEN SCIENCES IRELAND UC | 2015-07-15 | — | — | CN | disclosed |
| CN-103917540-A | Antibacterial piperidinyl-substituted 3, 4-dihydro-1H- [1,8] naphthyridinones | JANSSEN R & D IRELAND | 2014-07-09 | — | — | CN | disclosed |
| CN-103180307-A | Novel microbicides | SYNGENTA PARTICIPATIONS AG | 2013-06-26 | — | — | CN | disclosed |
| CN-1684958-A | Dihydro-dibenzo (A) anthracenes and relative compounds,composition and method | LILLY CO ELI (US) | 2005-10-19 | — | — | CN | disclosed |