Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.34 |
| ▸ | CHRNG | P07510 | 1/20 | 0.34 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.34 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.34 |
| ▸ | CHRND | Q07001 | 1/20 | 0.34 |
| ▸ | MAOB | P27338 | 2/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.31 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.30 |
| ▸ | RORC | P51449 | 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 | |
|---|---|---|---|---|
| SCHEMBL10434640 | 0.83 | UTS2R (0.35) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL11683957 | 0.81 | TAAR1 (0.33) | HSD11B1CYP3A4CYP2C9 | |
| SCHEMBL10486440 | 0.81 | HTR1A (0.36) | EGFRSLC6A3SLC6A2CHRNB2CHRNB4 | |
| SCHEMBL11684978 | 0.80 | HTR2A (0.41) | SLC6A3SLC6A2CHRNA1CHRNB1CHRNB2 | |
| SCHEMBL10551039 | 0.76 | — | — | |
| SCHEMBL11204773 | 0.75 | SLC6A4 (0.46) | SLC6A3SLC6A2CHRNA1CHRNGCHRNB1 | |
| SCHEMBL11684742 | 0.75 | MAPT (0.37) | CYP2C9 | |
| SCHEMBL2175183 | 0.75 | SLC6A3 (0.40) | EGFRSLC6A3SLC6A2CHRNA1CHRNG | |
| SCHEMBL10413318 | 0.73 | EGFR (0.38) | EGFRSLC6A3SLC6A2CHRNA1CHRNG | |
| SCHEMBL8756413 | 0.72 | SLC6A3 (0.38) | EGFRSLC6A3SLC6A2CHRNA1CHRNG |
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 |
|---|---|---|---|---|---|---|---|
| WO-1990008140-A1 | SUBSTITUTED TRIAZOLES, THEIR PREPARATION AND COMPOSITIONS, FOR USE AS FUNGICIDES | THE DOW CHEMICAL COMPANY (US) | 1990-07-26 | — | — | WO | claimed |
| EP-0380277-A1 | Substituted triazoles, their preparation and compositions, for use as fungicides | THE DOW CHEMICAL COMPANY (US) | 1990-08-01 | — | — | EP | disclosed |
| WO-1990008140-A1 | SUBSTITUTED TRIAZOLES, THEIR PREPARATION AND COMPOSITIONS, FOR USE AS FUNGICIDES | THE DOW CHEMICAL COMPANY (US) | 1990-07-26 | — | — | WO | disclosed |