Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE3B | Q13370 | 2/20 | 0.42 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.42 |
| ▸ | AHR | P35869 | 2/20 | 0.41 |
| ▸ | CMA1 | P23946 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.40 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 3/20 | 0.39 |
| ▸ | CDK1 | P06493 | 2/20 | 0.39 |
| ▸ | MET | P08581 | 1/20 | 0.39 |
| ▸ | MPO | P05164 | 5/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.38 |
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | HCK | P08631 | 1/20 | 0.38 |
| ▸ | SRC | P12931 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.38 |
| ▸ | MTOR | P42345 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29699016 | 0.73 | NFKB1 (0.35) | PIK3CDULK1 | |
| SCHEMBL29107848 | 0.71 | AR (0.43) | ADORA1ABL1EGFRSRC | |
| SCHEMBL30578587 | 0.71 | AR (0.43) | ADORA1ABL1EGFRSRC | |
| SCHEMBL27503715 | 0.71 | NPC1 (0.41) | ADORA2AADORA1 | |
| SCHEMBL28313382 | 0.71 | AHR (0.44) | AHRKDRCDK1ULK1 | |
| SCHEMBL4786964 | 0.70 | AHR (0.49) | AHRCMA1ADORA2AADORA1KDR | |
| SCHEMBL14325223 | 0.69 | AHR (0.41) | AHRCMA1ADORA2AADORA1RIPK2 | |
| SCHEMBL24143483 | 0.69 | TRPA1 (0.54) | PDE3BPDE3AMPOKCNH2 | |
| SCHEMBL7091832 | 0.67 | ESR1 (0.55) | AHRCMA1METMPOKCNH2 | |
| SCHEMBL30837013 | 0.67 | LRRK2 (0.47) | KDRCDK1 |
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-110036004-A | Inhibitors of cyclin dependent kinase 7(CDK7) | 希洛斯医药品股份有限公司 | 2019-07-19 | — | — | CN | disclosed |