Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KIT | P10721 | 6/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.38 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.37 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.37 |
| ▸ | RAF1 | P04049 | 1/20 | 0.37 |
| ▸ | BRAF | P15056 | 1/20 | 0.37 |
| ▸ | CSF1R | P07333 | 1/20 | 0.36 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 1/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 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 | |
|---|---|---|---|---|
| SCHEMBL11306 | 0.83 | SRC (0.47) | ALDH1A1KDM4EMAPK1KITMEN1 | |
| SCHEMBL10811 | 0.74 | SRC (0.57) | KITPIK3CDABL1EGFRHCK | |
| SCHEMBL217790 | 0.72 | ABL1 (0.49) | PIK3CDABL1EGFRHCKSRC | |
| SCHEMBL149180 | 0.72 | PIK3CD (0.55) | ALDH1A1KDM4EPIK3CDABL1EGFR | |
| SCHEMBL13717800 | 0.71 | CSNK1E (0.45) | PIK3CDABL1EGFRHCKSRC | |
| SCHEMBL13717774 | 0.70 | PIK3CD (0.41) | KITPIK3CDABL1EGFRHCK | |
| SCHEMBL13718435 | 0.70 | MKNK1 (0.39) | PIK3CDEGFRPIK3CG | |
| SCHEMBL19414295 | 0.69 | SRC (0.47) | PIK3CDABL1EGFRHCKSRC | |
| SCHEMBL13717565 | 0.69 | LRRK2 (0.40) | CSF1RPIK3CDPIK3CG | |
| SCHEMBL22692856 | 0.68 | ERBB2 (0.50) | PIK3CDSRCPIK3CAPIK3CBPIK3CG |
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-2020113642-A1 | SELECTIVE PI3Kδ INHIBITOR AND USE THEREOF | 安徽中科拓苒药物科学研究有限公司 | 2020-06-11 | — | — | WO | disclosed |