Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 1.00 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.77 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.70 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.70 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.70 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.70 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.70 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.70 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.70 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.70 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.70 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.70 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.70 |
| ▸ | APP | P05067 | 1/20 | 0.64 |
| ▸ | ZDHHC2 | Q9UIJ5 | 1/20 | 0.64 |
| ▸ | MMP1 | P03956 | 1/20 | 0.61 |
| ▸ | POLB | P06746 | 1/20 | 0.61 |
| ▸ | MMP2 | P08253 | 1/20 | 0.61 |
| ▸ | MMP9 | P14780 | 1/20 | 0.61 |
| ▸ | RECQL | P46063 | 1/20 | 0.61 |
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 | |
|---|---|---|---|---|
| N-Octylcinnamamide SCHEMBL10706126 | 1.00 | EGFR (1.00) | EGFRKMT2AHDAC3HDAC1HDAC2 | |
| N-Dodecylcinnamamide SCHEMBL28975087 | 1.00 | EGFR (1.00) | EGFRKMT2AHDAC3HDAC1HDAC2 | |
| N-Hexadecylcinnamamide SCHEMBL2727701 | 1.00 | EGFR (1.00) | EGFRKMT2AHDAC3HDAC1HDAC2 | |
| SCHEMBL28975079 | 1.00 | EGFR (1.00) | EGFRKMT2AHDAC3HDAC1HDAC2 | |
| N-Pentylcinnamamide SCHEMBL7913718 | 0.98 | EGFR (0.97) | EGFRKMT2AHDAC3HDAC1HDAC2 | |
| N-Pentylcinnamamide SCHEMBL7913716 | 0.98 | EGFR (0.97) | EGFRKMT2AHDAC3HDAC1HDAC2 | |
| N-Butylcinnamamide SCHEMBL6231267 | 0.94 | EGFR (0.88) | EGFRKMT2AHDAC3HDAC1HDAC2 | |
| N-Butylcinnamamide SCHEMBL3688039 | 0.94 | EGFR (0.88) | EGFRKMT2AHDAC3HDAC1HDAC2 | |
| SCHEMBL28975041 | 0.93 | EGFR (0.87) | EGFRKMT2AHDAC3HDAC1HDAC2 | |
| SCHEMBL6415859 | 0.92 | KMT2A (0.90) | EGFRKMT2AHDAC3HDAC1HDAC2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015042363-A1 | MOLECULES AND COMPOSITIONS THAT INHIBIT GRAM NEGATIVE BACTERIA AND THEIR USES | THE TRUSTEES OF PRINCETON UNIVERSITY (US) | 2015-03-26 | — | — | WO | disclosed |