Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | NR1I2 | O75469 | 14/20 | 0.46 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| SCHEMBL4647480 | 0.94 | ADRB3 (0.45) | ALDH1A1NR1I2ADRB3HPGDKMT2A | |
| SCHEMBL4605935 | 0.92 | ADRB3 (0.46) | ALDH1A1NR1I2ADRB3HPGDKMT2A | |
| SCHEMBL1377347 | 0.91 | NR1I2 (0.45) | ALDH1A1NR1I2ADRB3HPGDKMT2A | |
| SCHEMBL4914684 | 0.91 | NR1I2 (0.44) | ALDH1A1NR1I2ADRB3HPGDKMT2A | |
| SCHEMBL1379764 | 0.91 | NR1I2 (0.44) | ALDH1A1NR1I2ADRB3HPGDKMT2A | |
| SCHEMBL14185295 | 0.90 | ADRB3 (0.48) | ALDH1A1NR1I2ADRB3HPGDKMT2A | |
| SCHEMBL14185294 | 0.89 | ADRB3 (0.44) | NR1I2ADRB3HPGDKMT2A | |
| SCHEMBL1379766 | 0.89 | ADRB3 (0.48) | ALDH1A1NR1I2ADRB3HPGDKMT2A | |
| SCHEMBL4908069 | 0.89 | NR1I2 (0.43) | ALDH1A1NR1I2ADRB3HPGDKMT2A | |
| SCHEMBL4917492 | 0.89 | NR1I2 (0.43) | ALDH1A1NR1I2ADRB3HPGDKMT2A |
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-1943229-A1 | BENZIMIDAZOLE DERIVATIVES FOR USE AS BETA-3 RECEPTOR AGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2008-07-16 | — | — | EP | disclosed |
| WO-2007048842-A1 | BENZIMIDAZOLE DERIVATIVES FOR USE AS BETA-3 RECEPTOR AGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2007-05-03 | — | — | WO | disclosed |