Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.44 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.44 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.44 |
| ▸ | PGR | P06401 | 1/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
| ▸ | CACNA2D2 | Q9NY47 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | GPR84 | Q9NQS5 | 4/20 | 0.43 |
| ▸ | FFAR3 | O14843 | 2/20 | 0.43 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| 3-Methylbutanoic Acid SCHEMBL1331498 | 0.91 | — | — | |
| 3-Methylbutanoic Acid SCHEMBL467274 | 0.91 | TDP1 (0.56) | TDP1ALDH1A1CACNA2D1CACNB3CACNA1C | |
| 3-Methylbutanoic Acid SCHEMBL43436 | 0.91 | — | — | |
| 3-Methylbutanoic Acid SCHEMBL627178 | 0.89 | GPR84 (0.56) | TDP1ALDH1A1GPR84SLC22A6 | |
| 3-Methylbutanoic Acid SCHEMBL1373554 | 0.88 | TDP1 (0.48) | TDP1ALDH1A1CACNA2D1CACNB3CACNA1C | |
| 3-Methylbutanoic Acid SCHEMBL5511012 | 0.88 | FFAR3 (0.59) | TDP1ALDH1A1CACNA2D1CACNB3CACNA1C | |
| 3-Methylbutanoic Acid SCHEMBL6139482 | 0.88 | — | — | |
| 3-Methylbutanoic Acid SCHEMBL6113289 | 0.88 | — | — | |
| 3-Methylbutanoic Acid SCHEMBL9185998 | 0.88 | — | — | |
| 3-Methylbutanoic Acid SCHEMBL15772049 | 0.88 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106602013-B | Preparation method of sulfur-activated carbon/graphene composite material | 中国科学院山西煤炭化学研究所 | 2020-11-27 | — | — | CN | disclosed |
| US-8834865-B2 | Delivery system for co-formulated enzyme and substrate | DANISCO US INC. (US) | 2014-09-16 | — | — | US | disclosed |
| EP-2350250-B1 | DELIVERY SYSTEM FOR CO-FORMULATED ENZYME AND SUBSTRATE | DANISCO US INC (US) | 2014-02-19 | — | — | EP | disclosed |
| EP-2350250-A1 | DELIVERY SYSTEM FOR CO-FORMULATED ENZYME AND SUBSTRATE | Danisco US Inc. (US) | 2011-08-03 | — | — | EP | disclosed |
| WO-2010062745-A1 | DELIVERY SYSTEM FOR CO-FORMULATED ENZYME AND SUBSTRATE | DANISCO US INC. (US) | 2010-06-03 | — | — | WO | disclosed |