Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACVR1 | Q04771 | 2/20 | 0.64 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.64 |
| ▸ | ROS1 | P08922 | 1/20 | 0.64 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.64 |
| ▸ | PDGFRA | P16234 | 2/20 | 0.62 |
| ▸ | FER | P16591 | 1/20 | 0.62 |
| ▸ | LTK | P29376 | 1/20 | 0.62 |
| ▸ | CDK8 | P49336 | 1/20 | 0.62 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.62 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | CHEK1 | O14757 | 3/20 | 0.56 |
| ▸ | CSNK1G1 | Q9HCP0 | 1/20 | 0.56 |
| ▸ | EGFR | P00533 | 1/20 | 0.53 |
| ▸ | KDR | P35968 | 3/20 | 0.51 |
| ▸ | PDPK1 | O15530 | 4/20 | 0.50 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.50 |
| ▸ | FLT1 | P17948 | 1/20 | 0.50 |
| ▸ | PLK4 | O00444 | 2/20 | 0.49 |
| ▸ | PLK1 | P53350 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31419932 | 0.79 | TGM2 (0.66) | PDGFRAEGFRKDRPDPK1PDGFRB | |
| SCHEMBL5325427 | 0.79 | TGM2 (0.66) | PDGFRAEGFRKDRPDPK1PDGFRB | |
| SCHEMBL3614440 | 0.78 | CHEK1 (0.81) | ACVR1LRRK2ROS1CDK5PDGFRA | |
| SCHEMBL3616249 | 0.78 | LRRK2 (0.64) | ACVR1LRRK2ROS1CDK5PDGFRA | |
| SCHEMBL6298884 | 0.78 | ACVR1 (0.64) | ACVR1LRRK2ROS1CDK5PDGFRA | |
| SCHEMBL1368292 | 0.78 | LRRK2 (1.00) | ACVR1LRRK2ROS1CDK5PDGFRA | |
| SCHEMBL9094667 | 0.76 | ALOX5 (0.50) | PDGFRAMEN1KMT2AEGFRKDR | |
| Hydrochloric Acid SCHEMBL6299954 | 0.76 | LRRK2 (0.95) | ACVR1LRRK2ROS1CDK5PDGFRA | |
| SCHEMBL9094478 | 0.75 | MAPT (0.51) | MEN1KMT2ACHEK1NTRK1CCNA2 | |
| SCHEMBL30785241 | 0.75 | ALDH1A1 (0.52) | ACVR1LRRK2ROS1CDK5PDGFRA |
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-1996029316-A1 | NEW SULFONE ESTER ANALOGUES OF iso-CLOZAPINE AND RELATED STRUCTURES: ATYPICAL NEUROLEPTICS | WIKSTROEM HAAKAN (NL) | 1996-09-26 | — | — | WO | disclosed |