Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.60 |
| ▸ | MAOA | P21397 | 1/20 | 0.60 |
| ▸ | MAOB | P27338 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.44 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL30022074 | 0.92 | KDM1A (0.56) | KDM1AMAOAMAOBCYP1A2CYP3A4 | |
| SCHEMBL19656391 | 0.92 | KDM1A (0.56) | KDM1AMAOAMAOBCYP1A2CYP3A4 | |
| SCHEMBL31428579 | 0.89 | KDM1A (0.53) | KDM1AMAOAMAOBCYP1A2CYP3A4 | |
| SCHEMBL2092750 | 0.85 | KDM1A (0.52) | KDM1AMAOAMAOBCYP1A2CYP3A4 | |
| SCHEMBL13448854 | 0.83 | KDM1A (0.65) | KDM1AMAOAMAOBCYP1A2CYP3A4 | |
| Hydrochloric Acid SCHEMBL27632631 | 0.79 | MCHR1 (0.48) | KDM1AMAOAMAOBCYP3A4HDAC1 | |
| Hydrochloric Acid SCHEMBL27632629 | 0.79 | MCHR1 (0.48) | KDM1AMAOAMAOBCYP3A4HDAC1 | |
| SCHEMBL24943587 | 0.77 | HDAC1 (0.55) | KDM1AMAOAMAOBCYP1A2HDAC1 | |
| Hydrochloric Acid SCHEMBL6927696 | 0.77 | KDM1A (0.45) | KDM1AMAOAMAOBHDAC1HDAC2 | |
| SCHEMBL4034649 | 0.76 | SIGMAR1 (0.51) | KMT2AMEN1 |
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-3509627-A1 | LYSINE SPECIFIC HISTONE DEMETHYLASE-1 INHIBITORS AND USES THEREFOR | University of Canberra (AU) | 2019-07-17 | — | — | EP | disclosed |
| WO-2018045422-A1 | LYSINE SPECIFIC HISTONE DEMETHYLASE-1 INHIBITORS AND USES THEREFOR | UNIVERSITY OF CANBERRA (AU) | 2018-03-15 | — | — | WO | disclosed |