Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | WDR5 | P61964 | 1/20 | 0.74 |
| ▸ | CES1 | P23141 | 1/20 | 0.73 |
| ▸ | CA12 | O43570 | 1/20 | 0.71 |
| ▸ | CA1 | P00915 | 1/20 | 0.71 |
| ▸ | CA2 | P00918 | 1/20 | 0.71 |
| ▸ | CA9 | Q16790 | 1/20 | 0.71 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.67 |
| ▸ | MEN1 | O00255 | 2/20 | 0.67 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.64 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.62 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.62 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.62 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.62 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.62 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.62 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.62 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.62 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.62 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.62 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.62 |
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 | |
|---|---|---|---|---|
| SCHEMBL13028457 | 0.95 | WDR5 (0.68) | WDR5CES1CA12CA1CA2 | |
| SCHEMBL3558356 | 0.91 | WDR5 (0.63) | WDR5CES1CA12CA1CA2 | |
| SCHEMBL6554630 | 0.86 | CES1 (1.00) | WDR5CES1KMT2AMEN1HDAC1 | |
| SCHEMBL2474197 | 0.86 | CES1 (1.00) | WDR5CES1KMT2AMEN1HDAC1 | |
| SCHEMBL28262522 | 0.85 | MAPT (0.74) | WDR5CES1CA12CA9KMT2A | |
| SCHEMBL7932062 | 0.85 | CA12 (0.73) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL893905 | 0.84 | CA12 (0.73) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL3715141 | 0.84 | CA12 (0.75) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL11047587 | 0.84 | MEN1 (0.76) | WDR5CES1CA12CA9KMT2A | |
| SCHEMBL1834055 | 0.83 | CA12 (0.71) | WDR5CA12CA1CA2CA9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102395270-B | Novel compounds, pharmaceutical compositions containing same, methods of use for same, and methods for preparing same | FASGEN INC | 2014-11-12 | — | — | CN | disclosed |
| CN-102395270-A | Novel compounds, pharmaceutical compositions containing same, methods of use for same, and methods for preparing same | FASGEN INC | 2012-03-28 | — | — | CN | disclosed |
| WO-1995004740-A1 | 7α-AMINO-1,1-DIOXOCEFEM L-VALYLAMIDES | DOMPE' S.P.A. (IT) | 1995-02-16 | — | — | WO | disclosed |