Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 6/20 | 0.52 |
| ▸ | RAB9A | P51151 | 5/20 | 0.52 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MIF | P14174 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7795952 | 1.00 | NPC1 (0.52) | NPC1RAB9ASLC6A3KMT2AHTT | |
| SCHEMBL7801087 | 0.92 | NPC1 (0.52) | NPC1RAB9ASLC6A3KMT2AHTT | |
| SCHEMBL7795874 | 0.92 | NPC1 (0.55) | NPC1RAB9AKMT2AHTTLMNA | |
| SCHEMBL7795871 | 0.92 | NPC1 (0.55) | NPC1RAB9AKMT2AHTTLMNA | |
| SCHEMBL7801090 | 0.92 | NPC1 (0.52) | NPC1RAB9ASLC6A3KMT2AHTT | |
| SCHEMBL7803907 | 0.88 | NPC1 (0.48) | NPC1RAB9ASLC6A3KMT2AHTT | |
| SCHEMBL7803901 | 0.88 | NPC1 (0.48) | NPC1RAB9ASLC6A3KMT2AHTT | |
| SCHEMBL7803856 | 0.88 | KMT2A (0.54) | NPC1RAB9AKMT2AHTTLMNA | |
| SCHEMBL7803857 | 0.88 | KMT2A (0.54) | NPC1RAB9AKMT2AHTTLMNA | |
| SCHEMBL7806058 | 0.87 | HPGD (0.43) | NPC1RAB9AKMT2AHTTLMNA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1097117-A2 | ARYL VINYL ETHER DERIVATIVES AND THEIR USE AS HERBICIDES | AVENTIS AGRICULTURE LTD. (GB) | 2001-05-09 | — | — | EP | disclosed |
| WO-2000003975-A2 | ARYL VINYL ETHER DERIVATIVES AND THEIR USE AS HERBICIDES | AVENTIS AGRICULTURE LTD. (GB) | 2000-01-27 | — | — | WO | disclosed |