Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 2/20 | 0.37 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | PIN1 | Q13526 | 3/20 | 0.33 |
| ▸ | MME | P08473 | 2/20 | 0.33 |
| ▸ | ACE | P12821 | 2/20 | 0.33 |
| ▸ | CPA1 | P15085 | 2/20 | 0.33 |
| ▸ | ACE2 | Q9BYF1 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL29715079 | 0.99 | EPHX2 (0.39) | EPHX2CPB2SMN1; SMN2L3MBTL1PIN1 | |
| SCHEMBL27756051 | 0.99 | EPHX2 (0.39) | EPHX2CPB2SMN1; SMN2L3MBTL1PIN1 | |
| SCHEMBL27776882 | 0.88 | SMN1; SMN2 (0.33) | EPHX2SMN1; SMN2L3MBTL1EPHX1 | |
| SCHEMBL27756043 | 0.87 | PARP1 (0.33) | EPHX2SMN1; SMN2L3MBTL1ALDH1A1EPHX1 | |
| SCHEMBL30179278 | 0.86 | EPHX1 (0.34) | EPHX2SMN1; SMN2L3MBTL1ALDH1A1EPHX1 | |
| SCHEMBL13617941 | 0.86 | KDM1A (0.33) | CPB2 | |
| SCHEMBL9829688 | 0.82 | LMNA (0.43) | SMN1; SMN2ALDH1A1HSD17B10LMNA | |
| SCHEMBL9829694 | 0.82 | LMNA (0.43) | SMN1; SMN2ALDH1A1HSD17B10LMNA | |
| SCHEMBL9828543 | 0.81 | LMNA (0.42) | SMN1; SMN2CYP3A4LMNA | |
| SCHEMBL9828547 | 0.81 | LMNA (0.42) | SMN1; SMN2CYP3A4LMNA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101531637-A | A novel compound capable of restraining and blocking M2 ion channel activity and application thereof | CHINESE ACADEMY OF SCIENCES GU | 2009-09-16 | — | — | CN | claimed |
| CN-101531637-B | A novel compound capable of restraining and blocking M2 ion channel activity and application thereof | CHINESE ACADEMY OF SCIENCES GUANGZHOU INST OF BIOMEDICINE AND HEALTH | 2011-07-13 | — | — | CN | disclosed |
| CN-101531637-A | A novel compound capable of restraining and blocking M2 ion channel activity and application thereof | CHINESE ACADEMY OF SCIENCES GU | 2009-09-16 | — | — | CN | disclosed |