Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.66 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.66 |
| ▸ | CA1 | P00915 | 7/20 | 0.49 |
| ▸ | CA2 | P00918 | 7/20 | 0.49 |
| ▸ | CA9 | Q16790 | 7/20 | 0.49 |
| ▸ | CA12 | O43570 | 6/20 | 0.49 |
| ▸ | CA4 | P22748 | 6/20 | 0.49 |
| ▸ | CA5A | P35218 | 6/20 | 0.49 |
| ▸ | CA7 | P43166 | 6/20 | 0.49 |
| ▸ | CA5B | Q9Y2D0 | 6/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 2/20 | 0.43 |
| ▸ | SRC | P12931 | 1/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.40 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | F2 | P00734 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21815469 | 0.93 | TDP1 (0.66) | TDP1L3MBTL1CA1CA2CA9 | |
| SCHEMBL28101013 | 0.82 | L3MBTL1 (0.66) | TDP1L3MBTL1CA1CA2CA9 | |
| SCHEMBL28460825 | 0.81 | MAOB (0.50) | TDP1L3MBTL1CA1CA2CA9 | |
| SCHEMBL561190 | 0.80 | L3MBTL1 (1.00) | TDP1L3MBTL1CA1CA2CA9 | |
| Carbon Monoxide SCHEMBL6562620 | 0.79 | L3MBTL1 (0.87) | TDP1L3MBTL1CA1CA2CA9 | |
| SCHEMBL14566904 | 0.79 | L3MBTL1 (0.79) | TDP1L3MBTL1CA1CA2CA9 | |
| SCHEMBL28383839 | 0.79 | MAOB (0.47) | TDP1L3MBTL1CA1CA2CA9 | |
| SCHEMBL29157902 | 0.77 | L3MBTL1 (0.76) | TDP1L3MBTL1CA1CA2CA9 | |
| SCHEMBL483046 | 0.77 | L3MBTL1 (0.76) | TDP1L3MBTL1CA1CA2CA9 | |
| SCHEMBL28136591 | 0.77 | L3MBTL1 (0.83) | TDP1L3MBTL1CA1CA2CA9 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105968136-B | A kind of preparation method of fragrance phosphonate compound | 北京大学 | 2018-12-07 | — | — | CN | disclosed |
| CN-105968136-A | Preparation method of aromatic phosphonate compound | 北京大学 | 2016-09-28 | — | — | CN | disclosed |