Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.50 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.50 |
| ▸ | TLR7 | Q9NYK1 | 3/20 | 0.47 |
| ▸ | ABL1 | P00519 | 2/20 | 0.46 |
| ▸ | BCR | P11274 | 2/20 | 0.46 |
| ▸ | PARP10 | Q53GL7 | 5/20 | 0.45 |
| ▸ | FAAH | O00519 | 1/20 | 0.45 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.45 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.42 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.42 |
| ▸ | PARP16 | Q8N5Y8 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| Pyridine SCHEMBL22372443 | 0.91 | MKNK1 (0.51) | NPC1RAB9ACYP11B1CYP11B2TLR7 | |
| SCHEMBL22740915 | 0.88 | PARP10 (0.53) | NPC1RAB9AABL1BCRPARP10 | |
| SCHEMBL3537983 | 0.83 | NPC1 (0.59) | NPC1RAB9ACYP11B1CYP11B2TLR7 | |
| SCHEMBL324161 | 0.83 | PARP10 (0.59) | NPC1RAB9AABL1BCRPARP10 | |
| Hydrochloric Acid SCHEMBL3541282 | 0.82 | NPC1 (0.57) | NPC1RAB9ACYP11B1CYP11B2TLR7 | |
| Hydrochloric Acid SCHEMBL3785321 | 0.81 | PARP10 (0.57) | NPC1RAB9AABL1BCRPARP10 | |
| Hydrochloric Acid SCHEMBL11888844 | 0.81 | PARP10 (0.57) | NPC1RAB9AABL1BCRPARP10 | |
| Pyridine SCHEMBL22721341 | 0.81 | HDAC1 (0.54) | NPC1RAB9AABL1BCRKMT2A | |
| SCHEMBL4602009 | 0.80 | ELANE (0.56) | NPC1RAB9ACYP11B1CYP11B2TLR7 | |
| SCHEMBL30706505 | 0.79 | CYP11B1 (0.62) | NPC1RAB9ACYP11B1CYP11B2TLR7 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020241632-A1 | PYRIDINIUM SALT AND PEST CONTROL AGENT | 日本曹達株式会社 | 2020-12-03 | — | — | WO | disclosed |