Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.38 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | TPMT | P51580 | 1/20 | 0.35 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL11297147 | 0.88 | HDAC8 (0.37) | MAPTTSHRABCB1HPGD | |
| SCHEMBL11296873 | 0.86 | TDP1 (0.52) | TAS1R3TAS1R1MAPTHTTALDH1A1 | |
| SCHEMBL11298187 | 0.86 | TAS1R3 (0.40) | TAS1R3TAS1R1ALDH1A1HSD17B10KDM4E | |
| SCHEMBL11211541 | 0.85 | SLC6A2 (0.39) | MAPTCA12CA1CA2CA9 | |
| SCHEMBL11398910 | 0.84 | SMN1; SMN2 (0.51) | MAPK1HTTALDH1A1HSD17B10KDM4E | |
| SCHEMBL11407028 | 0.84 | TP53 (0.39) | MAPTALDH1A1HSD17B10TSHRABCB1 | |
| SCHEMBL11297218 | 0.83 | F10 (0.34) | MAPTMAPK1CA12CA1CA2 | |
| SCHEMBL11303227 | 0.83 | PSMB5 (0.37) | — | |
| SCHEMBL11299421 | 0.82 | F2 (0.37) | MAPTALDH1A1HSD17B10KDM4ETSHR | |
| SCHEMBL11301530 | 0.81 | PPARA (0.38) | MAPTMAPK1HTTALDH1A1KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4261732-A | Alkyl and alkoxyalkyl N-3-alkyl and N-3,5-dialkylbenzoyl-N-isopropylaminoacetate herbicides | PPG INDUSTRIES, INC. (US) | 1981-04-14 | — | — | US | claimed |
| WO-1981001407-A1 | NOVEL HALOPHENYL-PYRIDYL-ALLYLAMINE DERIVATIVES | ASTRA LAEKEMEDEL AB (SE) | 1981-05-28 | — | — | WO | disclosed |
| US-4261732-A | Alkyl and alkoxyalkyl N-3-alkyl and N-3,5-dialkylbenzoyl-N-isopropylaminoacetate herbicides | PPG INDUSTRIES, INC. (US) | 1981-04-14 | — | — | US | disclosed |