Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 6/20 | 0.55 |
| ▸ | KDR | P35968 | 8/20 | 0.55 |
| ▸ | ERBB2 | P04626 | 7/20 | 0.55 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.55 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.55 |
| ▸ | HDAC7 | Q8WUI4 | 3/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.55 |
| ▸ | HDAC10 | Q969S8 | 3/20 | 0.55 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.55 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.55 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.55 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.55 |
| ▸ | CSF1R | P07333 | 2/20 | 0.54 |
| ▸ | AURKA | O14965 | 4/20 | 0.51 |
| ▸ | FLT3 | P36888 | 1/20 | 0.51 |
| ▸ | BTK | Q06187 | 1/20 | 0.49 |
| ▸ | FYN | P06241 | 1/20 | 0.48 |
| ▸ | SRC | P12931 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL4361514 | 0.91 | BTK (0.52) | EGFRKDRERBB2HDAC3HDAC4 | |
| SCHEMBL4728574 | 0.86 | KDR (0.59) | EGFRKDRERBB2HDAC3HDAC4 | |
| SCHEMBL4340911 | 0.84 | KDR (0.60) | EGFRKDRERBB2HDAC3HDAC4 | |
| SCHEMBL4338383 | 0.84 | KDR (0.60) | EGFRKDRERBB2HDAC3HDAC4 | |
| SCHEMBL4737136 | 0.83 | KDR (0.69) | EGFRKDRERBB2HDAC3HDAC4 | |
| SCHEMBL4729356 | 0.83 | KDR (0.61) | EGFRKDRERBB2HDAC3HDAC4 | |
| SCHEMBL4739267 | 0.83 | KDR (0.69) | EGFRKDRERBB2HDAC3HDAC4 | |
| SCHEMBL1435666 | 0.82 | EGFR (0.79) | EGFRKDRERBB2HDAC3HDAC4 | |
| SCHEMBL4332854 | 0.81 | KDR (0.61) | EGFRKDRERBB2HDAC3HDAC4 | |
| SCHEMBL4330275 | 0.81 | KDR (0.61) | EGFRKDRERBB2HDAC3HDAC4 |
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-2009070328-A1 | MODULATORS OF THE EPIDERMAL GROWTH FACTOR RECEPTOR (EGFR) PATHWAY FOR USE IN THE TREATMENT OR PREVENTION OF SUBSTANCE ABUSE | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2009-06-04 | — | — | WO | disclosed |