Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.36 |
| ▸ | PRKCG | P05129 | 1/20 | 0.35 |
| ▸ | PRKCB | P05771 | 1/20 | 0.35 |
| ▸ | SRC | P12931 | 1/20 | 0.35 |
| ▸ | PRKCA | P17252 | 1/20 | 0.35 |
| ▸ | PRKCH | P24723 | 1/20 | 0.35 |
| ▸ | PRKCE | Q02156 | 1/20 | 0.35 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.35 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.35 |
| ▸ | CAMK2B | Q13554 | 1/20 | 0.35 |
| ▸ | CAMK2G | Q13555 | 1/20 | 0.35 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.35 |
| ▸ | CAMK2A | Q9UQM7 | 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 | |
|---|---|---|---|---|
| SCHEMBL9739656 | 0.89 | ALDH1A1 (0.42) | ALDH1A1TSHRSLC6A4ABCB1HTR2A | |
| SCHEMBL9212347 | 0.85 | ALDH1A1 (0.50) | ALDH1A1TSHRSLC6A4ABCB1HTR2A | |
| Hydrochloric Acid SCHEMBL9743101 | 0.81 | HTR1A (0.52) | SLC6A4HTR2A | |
| SCHEMBL9212261 | 0.79 | ABCB1 (0.49) | ALDH1A1TSHRSLC6A4ABCB1HTR2A | |
| SCHEMBL9213552 | 0.73 | ALDH1A1 (0.38) | ALDH1A1TSHRSLC6A4HTR2ABCHE | |
| Water SCHEMBL9739470 | 0.72 | HTR1A (0.45) | SLC6A4HTR2ABCHEACHE | |
| SCHEMBL9210128 | 0.70 | HTR1A (0.45) | TSHRSLC6A4HTR2AADRA1A | |
| SCHEMBL9216575 | 0.69 | CHRNB2 (0.37) | ALDH1A1HTR2AMEN1KMT2ALMNA | |
| SCHEMBL9215978 | 0.69 | PDE5A (0.39) | ACHE | |
| SCHEMBL9207818 | 0.68 | HTR1A (0.43) | ALDH1A1SLC6A4HTR2ABCHE |
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 |