Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | 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 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9212347 | 0.82 | ALDH1A1 (0.50) | ALDH1A1TSHRSLC6A4BCHEACHE | |
| SCHEMBL9206331 | 0.78 | HSD11B1 (0.38) | ACHEHTR2AHTR1ATMEM97 | |
| SCHEMBL9214068 | 0.77 | HTR1D (0.42) | TSHRSLC6A4GAAHTR1A | |
| SCHEMBL9212261 | 0.77 | ABCB1 (0.49) | ALDH1A1TSHRSLC6A4HTR2AKDM4E | |
| SCHEMBL9215340 | 0.76 | HTR1A (0.47) | SLC6A4BCHEACHEHTR2AHTR1A | |
| Hydrochloric Acid SCHEMBL9212006 | 0.76 | HTR1A (0.46) | SLC6A4BCHEACHEHTR2AHTR1A | |
| SCHEMBL9213653 | 0.73 | ALDH1A1 (0.45) | ALDH1A1TSHRSLC6A4BCHEACHE | |
| SCHEMBL9740802 | 0.72 | SIGMAR1 (0.45) | BCHE | |
| SCHEMBL9739700 | 0.72 | GRM5 (0.41) | SLC6A4ACHEHDAC8HDAC6HTR1A | |
| SCHEMBL9205462 | 0.72 | HTR1A (0.45) | SLC6A4BCHESMN1; SMN2HTR2AHTR1A |
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 |