Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | KIF11 | P52732 | 6/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9295799 | 0.81 | MAPT (0.47) | MAPTKMT2AKIF11DRD2OPRM1 | |
| SCHEMBL4055699 | 0.81 | CYP2C19 (0.50) | MAPTKMT2AKIF11DRD2OPRM1 | |
| SCHEMBL5898545 | 0.81 | MAPT (0.43) | MAPTKMT2AKIF11DRD2OPRM1 | |
| SCHEMBL12504230 | 0.78 | SMN1; SMN2 (0.38) | KMT2AKIF11DRD2OPRM1DRD3 | |
| SCHEMBL2095353 | 0.78 | CYP3A4 (0.53) | MAPTKMT2AKIF11CYP2C19HIF1A | |
| SCHEMBL13865463 | 0.77 | KIF11 (0.55) | MAPTKMT2AKIF11HTT | |
| SCHEMBL4058267 | 0.76 | CYP2C19 (0.49) | MAPTKMT2AKIF11DRD2OPRM1 | |
| SCHEMBL5705332 | 0.76 | HDAC11 (0.47) | MAPTKMT2ACYP2C19HIF1AESR1 | |
| SCHEMBL7005923 | 0.76 | HDAC11 (0.47) | MAPTKMT2ACYP2C19HIF1AESR1 | |
| SCHEMBL7025067 | 0.76 | HDAC11 (0.47) | MAPTKMT2ACYP2C19HIF1AESR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3114109-A1 | INHIBITORS OF HISTONE LYSINE SPECIFIC DEMETHYLASE (LSD1) AND HISTONE DEACETYLASES (HDACS) | The Johns Hopkins University (US) | 2017-01-11 | — | — | EP | disclosed |
| WO-2015134973-A1 | INHIBITORS OF HISTONE LYSINE SPECIFIC DEMETHYLASE (LSD1) AND HISTONE DEACETYLASES (HDACS) | THE JOHNS HOPKINS UNIVERSITY (US) | 2015-09-11 | — | — | WO | disclosed |