Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 8/20 | 0.49 |
| ▸ | RAB9A | P51151 | 8/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | CES1 | P23141 | 1/20 | 0.47 |
| ▸ | TNF | P01375 | 1/20 | 0.46 |
| ▸ | KLF5 | Q13887 | 1/20 | 0.46 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.46 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.46 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.46 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.46 |
| ▸ | CDK5 | Q00535 | 3/20 | 0.43 |
| ▸ | CDK5R1 | Q15078 | 3/20 | 0.43 |
| ▸ | PKM | P14618 | 2/20 | 0.43 |
| ▸ | MITF | O75030 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Methyl Alcohol SCHEMBL27566724 | 0.84 | ALDH1A1 (0.65) | MAPK1NPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL4914089 | 0.82 | CES2 (0.67) | MAPK1NPC1RAB9AALDH1A1CES2 | |
| SCHEMBL1505348 | 0.82 | — | — | |
| SCHEMBL61183 | 0.82 | — | — | |
| Acetamide SCHEMBL28279496 | 0.81 | ALDH1A1 (0.67) | MAPK1NPC1RAB9ASMN1; SMN2TP53 | |
| Fluoromethane SCHEMBL27831743 | 0.81 | ALDH1A1 (0.61) | MAPK1NPC1RAB9ASMN1; SMN2TP53 | |
| 2-Chloropyridine SCHEMBL27910343 | 0.81 | TDP1 (0.52) | MAPK1NPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL27667477 | 0.81 | NPC1 (0.43) | MAPK1NPC1RAB9ASMN1; SMN2TP53 | |
| SCHEMBL16143265 | 0.80 | CES2 (0.64) | MAPK1NPC1RAB9AALDH1A1CES2 | |
| SCHEMBL9094627 | 0.80 | CES2 (0.64) | MAPK1NPC1RAB9AALDH1A1CES2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114072395-A | Heterocyclic compounds and their use for treating helminth infections and diseases | 新基公司 | 2022-02-18 | — | — | CN | disclosed |