Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 2/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 2/20 | 0.38 |
| ▸ | CDK9 | P50750 | 1/20 | 0.37 |
| ▸ | ITGB3 | P05106 | 3/20 | 0.36 |
| ▸ | ITGA2B | P08514 | 3/20 | 0.36 |
| ▸ | GNRHR | P30968 | 1/20 | 0.36 |
| ▸ | KHK | P50053 | 1/20 | 0.36 |
| ▸ | GHSR | Q92847 | 1/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.35 |
| ▸ | BMPR1A | P36894 | 1/20 | 0.35 |
| ▸ | ACVRL1 | P37023 | 1/20 | 0.35 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9214240 | 0.96 | GRM5 (0.43) | GRM5DRD2PARP1HTR2AHTR2C | |
| SCHEMBL9208356 | 0.93 | GRM5 (0.42) | GRM5DRD2PARP1HTR2AHTR2C | |
| SCHEMBL9216049 | 0.85 | MEN1 (0.48) | GRM5DRD2PARP1HTR2AHTR2C | |
| SCHEMBL9205660 | 0.83 | GRM5 (0.42) | GRM5DRD2PARP1CDK9ITGB3 | |
| SCHEMBL9215737 | 0.82 | DRD2 (0.40) | GRM5DRD2PARP1BRD4CDK9 | |
| SCHEMBL9208378 | 0.82 | MEN1 (0.47) | GRM5DRD2HTR2AHTR2CHTR2B | |
| SCHEMBL9216770 | 0.81 | MEN1 (0.46) | GRM5DRD2HTR2AHTR2CHTR2B | |
| SCHEMBL9213734 | 0.80 | GRM5 (0.41) | GRM5DRD2PARP1ITGB3ITGA2B | |
| SCHEMBL9739728 | 0.79 | DRD2 (0.42) | GRM5DRD2PARP1HTR2AHTR2C | |
| SCHEMBL9739351 | 0.78 | ITGB3 (0.36) | GRM5DRD2PARP1BRD4CDK9 |
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 3 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 |
| EP-0292840-A2 | Cyclic amine derivatives, medicaments containing these compounds and procedure for their preparation | Dr. Karl Thomae GmbH (DE) | 1988-11-30 | — | — | EP | disclosed |