Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 15/20 | 0.34 |
| ▸ | MAOB | P27338 | 12/20 | 0.34 |
| ▸ | MAOA | P21397 | 7/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.34 |
| ▸ | CYP2B6 | P20813 | 3/20 | 0.34 |
| ▸ | RCOR1 | Q9UKL0 | 3/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27612309 | 0.71 | NOTUM (0.32) | — | |
| SCHEMBL16268040 | 0.67 | KDM1A (0.58) | KDM1AMAOBMAOACYP2C19CYP2B6 | |
| SCHEMBL16268038 | 0.67 | KDM1A (0.58) | KDM1AMAOBMAOACYP2C19CYP2B6 | |
| SCHEMBL17838765 | 0.67 | CACNA1B (0.30) | — | |
| SCHEMBL28168522 | 0.67 | NPC1 (0.47) | KDM1AMAOBMAOACYP2C19CYP2B6 | |
| SCHEMBL899802 | 0.67 | NPC1 (0.47) | KDM1AMAOBMAOACYP2C19CYP2B6 | |
| SCHEMBL105810 | 0.65 | HRH4 (0.39) | HTR1ASLC6A2HTR2CSLC6A3 | |
| SCHEMBL196791 | 0.65 | KDM4E (0.30) | CYP1A2LMNABLM | |
| SCHEMBL15146152 | 0.64 | KDM1A (0.50) | KDM1AMAOBHTR2CKDM1B | |
| SCHEMBL7429484 | 0.63 | CHRNB2 (0.40) | CYP2C19CYP1A2CYP2D6CYP2C9TAAR1 |
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-110312522-A | - 1 inhibitor of lysine specific histone demethylation enzyme and application thereof | 堪培拉大学 | 2019-10-08 | — | — | CN | disclosed |