Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.47 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.44 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.44 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.44 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 4/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 4/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 4/20 | 0.39 |
| ▸ | PLAU | P00749 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | OXTR | P30559 | 1/20 | 0.38 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | FDPS | P14324 | 1/20 | 0.38 |
| ▸ | FDFT1 | P37268 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Formic Acid SCHEMBL28190349 | 0.98 | NAPRT (0.45) | NAPRTKCNQ3KCNQ2KCNE1KCNQ1 | |
| SCHEMBL28048004 | 0.91 | NAPRT (0.45) | NAPRTKCNQ3KCNQ2KCNE1KCNQ1 | |
| SCHEMBL29538085 | 0.85 | — | — | |
| SCHEMBL17800 | 0.85 | — | — | |
| Formic Acid SCHEMBL28190351 | 0.84 | SMN1; SMN2 (0.42) | NAPRTKCNQ3KCNQ2KCNE1KCNQ1 | |
| SCHEMBL32681750 | 0.83 | — | — | |
| Ammonia Solution, Strong SCHEMBL14636438 | 0.83 | — | — | |
| Boric Acid SCHEMBL28809555 | 0.81 | NAPRT (0.45) | NAPRTKCNQ3KCNQ2KCNE1KCNQ1 | |
| Formic Acid SCHEMBL28841050 | 0.78 | RAB9A (0.47) | NAPRTKCNQ3KCNQ2ADRA2AADRA2B | |
| Formic Acid SCHEMBL27823119 | 0.78 | ALDH1A1 (0.44) | NAPRTL3MBTL1EGFRADRA2AADRA2B |
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 |
|---|---|---|---|---|---|---|---|
| CN-105801474-B | A kind of method of refined 3,6 lontrel | 张玲 | 2018-01-16 | — | — | CN | claimed |
| CN-104447529-B | Method for extracting and purifying 3,6-matrigon | 利尔化学股份有限公司 | 2017-05-24 | — | — | CN | claimed |