Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | HSD17B14 | Q9BPX1 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | F2 | P00734 | 2/20 | 0.39 |
| ▸ | F10 | P00742 | 2/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.39 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.39 |
| ▸ | ST14 | Q9Y5Y6 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | PDE5A | O76074 | 1/20 | 0.37 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL11368795 | 0.82 | P2RX3 (0.41) | KCNH2HSD17B14OPRM1F2F10 | |
| SCHEMBL11062094 | 0.81 | KCNH2 (0.38) | ALDH1A1KCNH2HSD17B14OPRM1F2 | |
| SCHEMBL11351076 | 0.81 | TDP1 (0.39) | ALDH1A1KCNH2HSD17B14F2F10 | |
| SCHEMBL7839773 | 0.81 | ALDH1A1 (0.58) | ALDH1A1 | |
| SCHEMBL11244705 | 0.79 | TDP1 (0.38) | ALDH1A1KCNH2HSD17B14OPRM1PPARG | |
| SCHEMBL11071446 | 0.79 | ALDH1A1 (0.38) | ALDH1A1KCNH2HSD17B14 | |
| SCHEMBL27690318 | 0.79 | KCNH2 (0.53) | ALDH1A1KCNH2HSD17B14CYP1A2CYP2C19 | |
| SCHEMBL10871695 | 0.79 | FFAR1 (0.53) | HSD17B14OPRM1F2F10PRSS1 | |
| SCHEMBL11065707 | 0.79 | ADAMTS4 (0.39) | ALDH1A1KDM4ERAB9AL3MBTL1 | |
| SCHEMBL11066972 | 0.78 | ALDH1A1 (0.36) | ALDH1A1KCNH2HSD17B14PPARG |
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 |
|---|---|---|---|---|---|---|---|
| JP-55092370-A | — | — | None | — | — | JP | disclosed |
| US-4338326-A | PESTICIDES | UNION CARBIDE CORPORATION (US) | 1982-07-06 | — | — | US | disclosed |
| US-4251662-A | INSECTICIDES, MITICIDES | NISSAN CHEMICAL INDUSTRIES, LIMITED (JP) | 1981-02-17 | — | — | US | disclosed |
| US-4223033-A | Substituted pyridine methyl esters of naphthyl acids | ZOECON CORPORATION (US) | 1980-09-16 | — | — | US | disclosed |
| JP-S5592370-A | PHENOXYPYRIDINE DERIVATIVE AND ITS PREPARATION | NISSAN CHEM IND LTD | 1980-07-12 | — | — | JP | disclosed |