Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11439760 | 0.87 | KCNH2 (0.30) | KCNH2 | |
| SCHEMBL8200128 | 0.83 | ALDH1A1 (0.38) | ALDH1A1CYP3A4HSD17B10KCNH2TSHR | |
| SCHEMBL11446227 | 0.79 | ALDH1A1 (0.39) | ALDH1A1CYP3A4HSD17B10KCNH2TSHR | |
| SCHEMBL11584127 | 0.77 | KCNH2 (0.33) | KCNH2TSHRTDP1 | |
| SCHEMBL3729094 | 0.74 | ALDH1A1 (0.31) | ALDH1A1CYP3A4HSD17B10 | |
| SCHEMBL11439726 | 0.72 | — | — | |
| SCHEMBL5933624 | 0.71 | ALDH1A1 (0.41) | ALDH1A1CYP3A4HSD17B10TSHRACHE | |
| SCHEMBL4756200 | 0.71 | ALDH1A1 (0.31) | ALDH1A1CYP3A4TSHR | |
| SCHEMBL11224465 | 0.71 | ACHE (0.34) | ACHE | |
| SCHEMBL11437171 | 0.70 | ACHE (0.34) | KCNH2TSHRACHETDP1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4192829-A | INSECTICIDES, MITICIDES, NEMATOCIDES | EXXON RESEARCH & ENGINEERING CO. (US) | 1980-03-11 | — | — | US | disclosed |
| US-4075332-A | Pesticidal O,S'-dialkyl S-hydrocarbylthioalkyl dithiophosphates and oxidized derivatives thereof | EXXON RESEARCH & ENGINEERING CO. (US) | 1978-02-21 | — | — | US | disclosed |