Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB3 | P13945 | 2/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | DUT | P33316 | 1/20 | 0.33 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.33 |
| ▸ | BRAF | P15056 | 3/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | PKM | P14618 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 4/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | FABP4 | P15090 | 1/20 | 0.32 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.31 |
| ▸ | PPARG | P37231 | 1/20 | 0.31 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL4918872 | 0.91 | MEN1 (0.37) | ADRB3OPRM1OPRD1MAPTKMT2A | |
| Trifluoroacetic Acid SCHEMBL4647049 | 0.89 | ADRB3 (0.42) | ADRB3SERPINE1 | |
| SCHEMBL4639786 | 0.84 | ADRB3 (0.42) | ADRB3OPRM1OPRD1ALDH1A1PKM | |
| SCHEMBL4639963 | 0.84 | ADRB3 (0.42) | ADRB3ALDH1A1PKMTSHRMAPK1 | |
| SCHEMBL4645777 | 0.83 | ADRB3 (0.40) | ADRB3OPRM1OPRD1ALDH1A1PKM | |
| SCHEMBL4918874 | 0.81 | ADRB3 (0.38) | ADRB3SERPINE1MAPTEPHX2PPARG | |
| Trifluoroacetic Acid SCHEMBL4642656 | 0.79 | ADRB3 (0.40) | ADRB3SERPINE1MAPTKMT2AEPHX2 | |
| SCHEMBL4605628 | 0.78 | ADRB3 (0.42) | ADRB3OPRM1OPRD1ALDH1A1PKM | |
| SCHEMBL4830639 | 0.78 | ADRB3 (0.36) | ADRB3OPRM1OPRD1ALDH1A1PKM | |
| SCHEMBL4639769 | 0.78 | ADRB3 (0.36) | ADRB3OPRM1OPRD1ALDH1A1PKM |
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 |