Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 12/20 | 0.52 |
| ▸ | EPHB4 | P54760 | 10/20 | 0.52 |
| ▸ | EGFR | P00533 | 9/20 | 0.52 |
| ▸ | ERBB2 | P04626 | 5/20 | 0.52 |
| ▸ | FLT4 | P35916 | 2/20 | 0.52 |
| ▸ | AURKA | O14965 | 1/20 | 0.52 |
| ▸ | INSR | P06213 | 1/20 | 0.52 |
| ▸ | FBP1 | P09467 | 1/20 | 0.52 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.52 |
| ▸ | CLK1 | P49759 | 1/20 | 0.52 |
| ▸ | TEK | Q02763 | 1/20 | 0.52 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.52 |
| ▸ | EPHA2 | P29317 | 11/20 | 0.50 |
| ▸ | CIT | O14578 | 1/20 | 0.49 |
| ▸ | GAK | O14976 | 1/20 | 0.49 |
| ▸ | EPHB6 | O15197 | 1/20 | 0.49 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.49 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.49 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.49 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL22394465 | 0.94 | EGFR (0.61) | KDREPHB4EGFRERBB2FLT4 | |
| Hydrochloric Acid SCHEMBL28384466 | 0.93 | EGFR (0.60) | KDREPHB4EGFRERBB2FLT4 | |
| SCHEMBL28424820 | 0.90 | EGFR (0.58) | KDREPHB4EGFREPHA2GAK | |
| SCHEMBL28427303 | 0.88 | EGFR (0.60) | KDREGFRERBB2FBP1EPHA2 | |
| SCHEMBL15520010 | 0.81 | ENPP1 (0.50) | KDREPHB4EGFRERBB2EPHA2 | |
| SCHEMBL22394455 | 0.79 | EGFR (0.66) | KDREPHB4EGFRERBB2PDGFRB | |
| SCHEMBL15519473 | 0.79 | HDAC1 (0.61) | KDREGFRAURKAAURKBLCK | |
| SCHEMBL15520192 | 0.79 | HDAC1 (0.63) | KDREGFRAURKAAURKBEPHA2 | |
| SCHEMBL13189303 | 0.73 | EGFR (0.70) | KDREPHB4EGFRERBB2FLT4 | |
| SCHEMBL27957018 | 0.73 | EGFR (0.88) | KDREPHB4EGFRERBB2FLT4 |
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-111298127-A | Composition comprising histamine release-promoting substance and inhibitory compound, and oral solid preparation containing the same | 黄泳华 | 2020-06-19 | — | — | CN | claimed |
| CN-111298127-A | Composition comprising histamine release-promoting substance and inhibitory compound, and oral solid preparation containing the same | 黄泳华 | 2020-06-19 | — | — | CN | disclosed |