Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 4/20 | 0.73 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.73 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.73 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.73 |
| ▸ | ADRB3 | P13945 | 12/20 | 0.57 |
| ▸ | BACE1 | P56817 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.51 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.51 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | DRD2 | P14416 | 2/20 | 0.51 |
| ▸ | DRD1 | P21728 | 2/20 | 0.51 |
| ▸ | DRD4 | P21917 | 2/20 | 0.51 |
| ▸ | DRD5 | P21918 | 2/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.51 |
| ▸ | DRD3 | P35462 | 2/20 | 0.51 |
| ▸ | RECQL | P46063 | 2/20 | 0.51 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL13293368 | 0.86 | ADRA2A (0.75) | ADRA2AADRA1AADRA2BADRA2CADRB3 | |
| SCHEMBL5508431 | 0.83 | ADRA2C (0.50) | ADRA2AADRA1AADRA2BADRA2CTP53 | |
| SCHEMBL8632112 | 0.82 | ADRA2A (0.69) | ADRA2AADRA1AADRA2BADRA2CADRB3 | |
| SCHEMBL30841998 | 0.80 | ADRA2A (0.62) | ADRA2AADRA1AADRA2BADRA2CADRB3 | |
| Hydrochloric Acid SCHEMBL11670739 | 0.80 | ADRA2B (0.70) | ADRA2AADRA1AADRA2BADRA2CADRB3 | |
| SCHEMBL7040773 | 0.79 | ADRA2A (0.66) | ADRA2AADRA1AADRA2BADRA2CADRB3 | |
| SCHEMBL955247 | 0.79 | TRPV1 (0.51) | — | |
| SCHEMBL4304097 | 0.79 | ADRA2A (0.47) | ADRA2AADRA1AADRA2BADRA2CMAPT | |
| SCHEMBL7242198 | 0.79 | ADRA2A (0.61) | ADRA2AADRA1AADRA2BADRA2CADRB3 | |
| SCHEMBL10778997 | 0.79 | ADRA1A (0.64) | ADRA2AADRA1AADRA2BADRA2CADRB3 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2119700-B1 | BENZYLAMINE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE ACID ADDITION SALT THEREOF, AND USE THEREOF FOR MEDICAL PURPOSES | TORAY INDUSTRIES (JP) | 2012-08-01 | — | — | EP | disclosed |
| EP-2119700-A1 | BENZYLAMINE DERIVATIVE OR PHARMACEUTICALLY ACCEPTABLE ACID ADDITION SALT THEREOF, AND USE THEREOF FOR MEDICAL PURPOSES | Toray Industries, Inc. (JP) | 2009-11-18 | — | — | EP | disclosed |
| EP-0189473-B1 | NEW DOPAMINE DERIVATIVES, PROCESS FOR THEIR PRODUCTION, AND THEIR USE AS MEDICINAL PRODUCTS | SCHERING AKTIENGESELLSCHAFT (DE) | 1992-05-27 | — | — | EP | disclosed |
| US-4958026-A | HYPOTENSIVE AGENTS | SCHERING AKTIENGESLLSCHAFT (DE) | 1990-09-18 | — | — | US | disclosed |
| EP-0189473-A1 | NEW DOPAMINE DERIVATIVES, PROCESS FOR THEIR PRODUCTION, AND THEIR USE AS MEDICINAL PRODUCTS. | SCHERING AG (DE) | 1986-08-06 | — | — | EP | disclosed |
| WO-1986001204-A1 | NEW DOPAMINE DERIVATIVES, PROCESS FOR THEIR PRODUCTION, AND THEIR USE AS MEDICINAL PRODUCTS | SCHERING AKTIENGESELLSCHAFT (DE) | 1986-02-27 | — | — | WO | disclosed |