Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 3/20 | 0.43 |
| ▸ | SRC | P12931 | 2/20 | 0.43 |
| ▸ | BAZ2B | Q9UIF8 | 3/20 | 0.38 |
| ▸ | BAZ2A | Q9UIF9 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 3/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NSD2 | O96028 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL367222 | 0.92 | EGFR (0.41) | EGFRSRCBAZ2BBAZ2AHTR2A | |
| SCHEMBL365023 | 0.89 | EGFR (0.40) | EGFRSRCALDH1A1HPGDHTR2A | |
| SCHEMBL365789 | 0.88 | EGFR (0.41) | EGFRSRCBAZ2BBAZ2AALDH1A1 | |
| SCHEMBL367256 | 0.84 | EGFR (0.40) | EGFRSRCBAZ2BBAZ2AALDH1A1 | |
| SCHEMBL365021 | 0.83 | SMN1; SMN2 (0.42) | EGFRSRCHPGDMAPTKMT2A | |
| SCHEMBL366821 | 0.79 | AGTR1 (0.41) | EGFRSRCALDH1A1HPGDPOLB | |
| SCHEMBL367330 | 0.79 | EGFR (0.46) | EGFRSRCBAZ2BBAZ2AALDH1A1 | |
| SCHEMBL365256 | 0.77 | EGFR (0.40) | EGFRSRCALDH1A1MEN1KMT2A | |
| SCHEMBL367766 | 0.76 | L3MBTL1 (0.43) | EGFRSRCHPGDMAPTKMT2A | |
| SCHEMBL366567 | 0.76 | PSEN1 (0.38) | EGFRSRCALDH1A1POLBKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012007008-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | claimed |
| WO-2012007008-A1 | INHIBITORS OF HDME | EPITHERAPEUTICS APS (DK) | 2012-01-19 | — | — | WO | disclosed |