Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCF1 | P14598 | 1/20 | 0.44 |
| ▸ | NR4A2 | P43354 | 2/20 | 0.43 |
| ▸ | CCNC | P24863 | 1/20 | 0.36 |
| ▸ | CDK8 | P49336 | 1/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
| ▸ | HCK | P08631 | 1/20 | 0.36 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.36 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 1/20 | 0.36 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.36 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.36 |
| ▸ | PRKDC | P78527 | 1/20 | 0.36 |
| ▸ | SOS2 | Q07890 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | TNF | P01375 | 5/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28219960 | 1.00 | NCF1 (0.44) | NCF1NR4A2CCNCCDK8PIK3CD | |
| SCHEMBL28860237 | 0.90 | NCF1 (0.44) | NCF1NR4A2CCNCCDK8EGFR | |
| SCHEMBL28860238 | 0.77 | MET (0.47) | SRCKDRHSP90AA1HSP90AB1MAPT | |
| SCHEMBL25556184 | 0.77 | NR4A2 (0.56) | NCF1NR4A2PIK3CDABL1EGFR | |
| Quinoline SCHEMBL28220135 | 0.75 | MET (0.46) | SRCKDRHSP90AA1HSP90AB1MAPT | |
| SCHEMBL28219978 | 0.70 | MET (0.35) | — | |
| SCHEMBL10389148 | 0.69 | ALDH1A1 (0.41) | MEN1MAPTKMT2A | |
| SCHEMBL4155195 | 0.69 | NR4A2 (0.54) | NCF1NR4A2PIK3CDABL1EGFR | |
| SCHEMBL28220522 | 0.69 | CYP1A2 (0.44) | LMNAMAPT | |
| SCHEMBL16446547 | 0.68 | NR4A2 (0.61) | NCF1NR4A2CCNCCDK8SOS2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108137547-A | It can be used as the heterocyclic compound of TNF α conditioning agent | 百时美施贵宝公司 | 2018-06-08 | — | — | CN | disclosed |