Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 3/20 | 0.51 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9215591 | 0.99 | ABCB1 (0.50) | ABCB1ADRA1BDRD2MEN1KMT2A | |
| SCHEMBL9206439 | 0.95 | ABCB1 (0.49) | ABCB1ADRA1BHTR1ADRD4DRD3 | |
| SCHEMBL9215106 | 0.94 | ADRA1B (0.44) | ABCB1ADRA1BDRD2 | |
| Hydrochloric Acid SCHEMBL9213140 | 0.94 | ABCB1 (0.48) | ABCB1ADRA1BHTR1ADRD4DRD3 | |
| SCHEMBL9740001 | 0.94 | ADRA1B (0.45) | ABCB1ADRA1BDRD2MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL9206636 | 0.93 | ABCB1 (0.48) | ABCB1ADRA1B | |
| Hydrochloric Acid SCHEMBL9208133 | 0.90 | TDP1 (0.44) | ABCB1DRD2KMT2ADRD3TDP1 | |
| Hydrochloric Acid SCHEMBL9212198 | 0.88 | ADRA1B (0.44) | ADRA1BDRD2 | |
| Hydrochloric Acid SCHEMBL9211764 | 0.87 | ADRA1B (0.43) | ABCB1ADRA1BMEN1KMT2AHTR1A | |
| Hydrochloric Acid SCHEMBL9209383 | 0.87 | HRH3 (0.47) | ADRA1B |
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 |