Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | 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 | |
|---|---|---|---|---|
| SCHEMBL792902 | 0.73 | ALDH1A1 (0.36) | CYP1A2TSHRALDH1A1LMNAKMT2A | |
| SCHEMBL10588380 | 0.73 | — | — | |
| SCHEMBL5601076 | 0.66 | NPC1 (0.37) | CYP1A2TSHRALDH1A1 | |
| SCHEMBL5602519 | 0.65 | ENPP1 (0.34) | TSHRALDH1A1MEN1KMT2ATDP1 | |
| SCHEMBL5600567 | 0.65 | NOS1 (0.38) | — | |
| SCHEMBL4821733 | 0.64 | CYP1A2 (0.35) | CYP1A2CYP2A6TSHRALDH1A1LMNA | |
| SCHEMBL5600295 | 0.63 | NOS1 (0.39) | — | |
| Water SCHEMBL20742739 | 0.62 | MAPT (0.33) | — | |
| SCHEMBL2294957 | 0.62 | MAPT (0.33) | — | |
| SCHEMBL10469489 | 0.60 | MAPK13 (0.31) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3400223-A1 | MICROBIOCIDAL OXADIAZOLE DERIVATIVES | Syngenta Participations AG (CH) | 2018-11-14 | — | — | EP | disclosed |
| WO-2017118689-A1 | MICROBIOCIDAL OXADIAZOLE DERIVATIVES | SYNGENTA PARTICIPATIONS AG (CH) | 2017-07-13 | — | — | WO | disclosed |
| US-6130220-A | ENZYME INHIBITORS | SYNTEX (USA) INC. (US) | 2000-10-10 | — | — | US | disclosed |
| US-4242507-A | Sulfonic acid esters | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1980-12-30 | — | — | US | disclosed |