Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 2/20 | 0.36 |
| ▸ | CES2 | O00748 | 2/20 | 0.36 |
| ▸ | CES1 | P23141 | 2/20 | 0.36 |
| ▸ | SRC | P12931 | 1/20 | 0.34 |
| ▸ | HCAR1 | Q9BXC0 | 1/20 | 0.34 |
| ▸ | PPARG | P37231 | 5/20 | 0.34 |
| ▸ | PPARA | Q07869 | 5/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.34 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.33 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.33 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.33 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.33 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.33 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.33 |
| ▸ | APP | P05067 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7965444 | 0.90 | CES2 (0.36) | GRM2CES2CES1SRCHCAR1 | |
| SCHEMBL8525339 | 0.81 | AKR1C4 (0.45) | SRCHCAR1HPGDMEN1CYP1A2 | |
| SCHEMBL4068539 | 0.79 | CES2 (0.41) | CES2CES1SRCHCAR1 | |
| SCHEMBL6306274 | 0.77 | TPMT (0.39) | SRCHCAR1NOTUMHPGDMEN1 | |
| SCHEMBL5784974 | 0.71 | DPP4 (0.43) | CES2CES1HCAR1NOTUMTTR | |
| SCHEMBL5255790 | 0.71 | CES2 (0.43) | CES2CES1SRC | |
| SCHEMBL1819883 | 0.70 | TTR (0.41) | MEN1CYP1A2KMT2ATTR | |
| SCHEMBL6838455 | 0.68 | ALDH1A1 (0.42) | HPGDMEN1KMT2A | |
| SCHEMBL6029780 | 0.67 | HTT (0.41) | MEN1CYP1A2CYP3A4KMT2A | |
| SCHEMBL7492812 | 0.67 | GRM8 (0.36) | SRC |
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 |
|---|---|---|---|---|---|---|---|
| US-6242451-B1 | Fungicidal trihalophenyl-triazolopyrimidines | BASF AKTIENGESELLSCHAFT | 2001-06-05 | — | — | US | disclosed |