Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4B | Q07343 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | AXL | P30530 | 5/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
| ▸ | MET | P08581 | 10/20 | 0.35 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.34 |
| ▸ | SLC11A2 | P49281 | 1/20 | 0.34 |
| ▸ | KDR | P35968 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21187092 | 0.87 | EPHX2 (0.38) | MET | |
| SCHEMBL21187154 | 0.84 | NPC1 (0.36) | METKDR | |
| SCHEMBL21187097 | 0.82 | IDO1 (0.40) | — | |
| SCHEMBL21187096 | 0.81 | MEN1 (0.39) | KDR | |
| SCHEMBL21187168 | 0.79 | GRM4 (0.41) | PDE4BPDE4DCASP3CDK9CASP7 | |
| SCHEMBL21187166 | 0.79 | MET (0.37) | PDE4BPDE4DAXLCASP3CDK9 | |
| SCHEMBL21187159 | 0.76 | IDO1 (0.37) | METKDR | |
| SCHEMBL21187156 | 0.72 | NPC1 (0.43) | CASP3 | |
| SCHEMBL21187221 | 0.70 | IDO1 (0.39) | MET | |
| SCHEMBL21187219 | 0.68 | CHRM4 (0.37) | — |
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-2019141095-A1 | AMIDINE AND GUANIDINE DERIVATIVE, PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF | 四川科伦博泰生物医药股份有限公司 | 2019-07-25 | — | — | WO | disclosed |