Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.65 |
| ▸ | FFAR3 | O14843 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.53 |
| ▸ | TSHR | P16473 | 5/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.50 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.48 |
| ▸ | PPARG | P37231 | 6/20 | 0.48 |
| ▸ | PPARD | Q03181 | 6/20 | 0.48 |
| ▸ | PPARA | Q07869 | 6/20 | 0.48 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.48 |
| ▸ | TLR2 | O60603 | 2/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | FABP4 | P15090 | 2/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.48 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.48 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| Propionic Acid SCHEMBL107943 | 1.00 | ALDH1A1 (0.65) | ALDH1A1FFAR3SMN1; SMN2TSHRLMNA | |
| Propionic Acid SCHEMBL5317229 | 0.95 | ALDH1A1 (0.58) | ALDH1A1FFAR3SMN1; SMN2TSHRLMNA | |
| Propionic Acid SCHEMBL5314334 | 0.92 | ALDH1A1 (0.55) | ALDH1A1FFAR3SMN1; SMN2TSHRLMNA | |
| Propionic Acid SCHEMBL5313043 | 0.90 | ALDH1A1 (0.52) | ALDH1A1FFAR3SMN1; SMN2TSHRLMNA | |
| Myristyl Alcohol SCHEMBL16212814 | 0.89 | TSHR (0.68) | ALDH1A1FFAR3SMN1; SMN2TSHRLMNA | |
| Myristyl Alcohol SCHEMBL28353736 | 0.89 | TSHR (0.68) | ALDH1A1FFAR3SMN1; SMN2TSHRLMNA | |
| 1-Pentanol SCHEMBL28864988 | 0.89 | SMN1; SMN2 (0.63) | ALDH1A1FFAR3SMN1; SMN2TSHRLMNA | |
| Cetyl Alcohol SCHEMBL27622135 | 0.89 | TSHR (0.68) | ALDH1A1FFAR3SMN1; SMN2TSHRLMNA | |
| Cetostearyl Alcohol SCHEMBL27505872 | 0.89 | TSHR (0.68) | ALDH1A1FFAR3SMN1; SMN2TSHRLMNA | |
| Dodecanol SCHEMBL27696059 | 0.89 | TSHR (0.68) | ALDH1A1FFAR3SMN1; SMN2TSHRLMNA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117794928-A | Substituted 1,2, 4-thiadiazolyl nicotinamide, salts or N-oxides thereof and their use as herbicidal active substances | 拜耳公司 | 2024-03-29 | — | — | CN | disclosed |