Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB3 | P13945 | 2/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 9/20 | 0.40 |
| ▸ | HPGD | P15428 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | IDH1 | O75874 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | F2 | P00734 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4645777 | 0.95 | ADRB3 (0.40) | ADRB3NR1I2HPGDALDH1A1LMNA | |
| SCHEMBL4908161 | 0.90 | NR1I2 (0.41) | ADRB3NR1I2HPGDALDH1A1LMNA | |
| SCHEMBL4605628 | 0.90 | ADRB3 (0.42) | ADRB3NR1I2HPGDALDH1A1LMNA | |
| SCHEMBL4777051 | 0.90 | ADRB3 (0.37) | ADRB3NR1I2HPGDALDH1A1LMNA | |
| SCHEMBL1379766 | 0.89 | ADRB3 (0.48) | ADRB3NR1I2HPGDALDH1A1LMNA | |
| SCHEMBL4840597 | 0.89 | ADRB3 (0.37) | ADRB3NR1I2HPGDALDH1A1LMNA | |
| SCHEMBL4605863 | 0.88 | NR1I2 (0.40) | ADRB3NR1I2HPGDALDH1A1LMNA | |
| SCHEMBL4830639 | 0.87 | ADRB3 (0.36) | ADRB3NR1I2HPGDALDH1A1LMNA | |
| SCHEMBL4895290 | 0.87 | HPGD (0.38) | ADRB3NR1I2HPGDALDH1A1LMNA | |
| SCHEMBL4639769 | 0.87 | ADRB3 (0.36) | ADRB3NR1I2HPGDALDH1A1OPRM1 |
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 |