Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | BRD4 | O60885 | 3/20 | 0.35 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | KHK | P50053 | 1/20 | 0.34 |
| ▸ | CDK9 | P50750 | 1/20 | 0.33 |
| ▸ | SYK | P43405 | 1/20 | 0.33 |
| ▸ | NAAA | Q02083 | 1/20 | 0.33 |
| ▸ | GNRHR | P30968 | 1/20 | 0.33 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 3/20 | 0.32 |
| ▸ | CCR2 | P41597 | 1/20 | 0.32 |
| ▸ | GHSR | Q92847 | 1/20 | 0.32 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | DRD3 | P35462 | 1/20 | 0.31 |
| ▸ | HCN4 | Q9Y3Q4 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9739351 | 0.92 | ITGB3 (0.36) | DRD2PARP1BRD4GRM5KHK | |
| SCHEMBL9204902 | 0.88 | SMN1; SMN2 (0.47) | DRD2KCNH2CHRM2HTR1ASLC6A4 | |
| SCHEMBL9214240 | 0.86 | GRM5 (0.43) | DRD2PARP1BRD4GRM5KHK | |
| SCHEMBL9207567 | 0.85 | DRD2 (0.39) | DRD2PARP1GRM5CDK9NAAA | |
| SCHEMBL9212186 | 0.84 | SMN1; SMN2 (0.48) | DRD2PARP1KCNH2CHRM2HTR1A | |
| SCHEMBL9740805 | 0.83 | PARP1 (0.45) | DRD2PARP1GRM5KHK | |
| SCHEMBL9208151 | 0.82 | GRM5 (0.44) | DRD2PARP1BRD4GRM5KHK | |
| SCHEMBL9740567 | 0.82 | DRD2 (0.41) | DRD2PARP1GRM5KHKCDK9 | |
| SCHEMBL9740563 | 0.78 | DRD2 (0.39) | DRD2PARP1GRM5KHKCDK9 | |
| SCHEMBL9208356 | 0.77 | GRM5 (0.42) | DRD2PARP1GRM5KHKCDK9 |
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-0292840-B1 | Cyclic amine derivatives, medicaments containing these compounds and procedure for their preparation | THOMAE GMBH DR K (DE) | 1995-08-09 | — | — | EP | disclosed |
| US-5175157-A | Cardiovascular disorders | BOEHRINGER INGELHEIM GMBH (DE) | 1992-12-29 | — | — | US | disclosed |