Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 5/20 | 0.60 |
| ▸ | JAK2 | O60674 | 4/20 | 0.60 |
| ▸ | EGFR | P00533 | 2/20 | 0.55 |
| ▸ | FGFR2 | P21802 | 2/20 | 0.54 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.52 |
| ▸ | KDR | P35968 | 1/20 | 0.52 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.47 |
| ▸ | CDK4 | P11802 | 5/20 | 0.47 |
| ▸ | CCND1 | P24385 | 3/20 | 0.47 |
| ▸ | CCND2 | P30279 | 2/20 | 0.47 |
| ▸ | CCND3 | P30281 | 2/20 | 0.47 |
| ▸ | AURKA | O14965 | 2/20 | 0.46 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.46 |
| ▸ | BTK | Q06187 | 1/20 | 0.46 |
| ▸ | SYK | P43405 | 1/20 | 0.46 |
| ▸ | FGFR4 | P22455 | 2/20 | 0.45 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.45 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.45 |
| ▸ | CDK1 | P06493 | 1/20 | 0.45 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL16514634 | 0.83 | BRD4 (0.53) | BRD4JAK2EGFRFGFR2FGFR1 | |
| SCHEMBL16513550 | 0.83 | BRD4 (0.53) | BRD4JAK2EGFRFGFR2FGFR1 | |
| SCHEMBL16514536 | 0.82 | EGFR (0.70) | BRD4JAK2EGFRFGFR2FGFR1 | |
| SCHEMBL16514597 | 0.81 | TTK (0.56) | BRD4JAK2EGFRFGFR2FGFR1 | |
| SCHEMBL29575830 | 0.81 | JAK2 (0.66) | BRD4JAK2EGFRFGFR2FGFR1 | |
| SCHEMBL19096959 | 0.80 | MAPK10 (0.55) | BRD4JAK2EGFRFGFR2CDK4 | |
| SCHEMBL16514362 | 0.80 | JAK2 (0.70) | BRD4JAK2EGFRFGFR2FGFR1 | |
| SCHEMBL29846917 | 0.80 | JAK2 (0.70) | BRD4JAK2EGFRFGFR2FGFR1 | |
| SCHEMBL29576100 | 0.80 | JAK2 (0.67) | BRD4JAK2EGFRFGFR2FGFR1 | |
| SCHEMBL16513961 | 0.80 | BRD4 (0.73) | BRD4JAK2EGFRFGFR2FGFR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3035936-A2 | CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS | NeuPharma, Inc. (US) | 2016-06-29 | — | — | EP | disclosed |
| WO-2015027222-A2 | CERTAIN CHEMICAL ENTITIES, COMPOSITIONS, AND METHODS | NEUPHARMA, INC. (US) | 2015-02-26 | — | — | WO | disclosed |