Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13698799 | 0.87 | KDM4E (0.69) | KDM4EKMT2AMEN1CYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL1728657 | 0.85 | KDM4E (0.67) | KDM4EKMT2AMEN1CYP1A2CYP2D6 | |
| SCHEMBL12464797 | 0.83 | KDM4E (0.57) | KDM4EKMT2AMEN1CYP1A2CYP2D6 | |
| SCHEMBL13467867 | 0.81 | CYP2D6 (0.79) | KDM4EKMT2AMEN1CYP1A2CYP2D6 | |
| SCHEMBL8232159 | 0.79 | KDM4E (0.79) | KDM4EKMT2AMEN1CYP1A2CYP2D6 | |
| Hydrochloric Acid SCHEMBL1730310 | 0.77 | KDM4E (0.77) | KDM4EKMT2AMEN1CYP1A2CYP2D6 | |
| SCHEMBL23366615 | 0.77 | KDM4E (0.61) | KDM4EKMT2AMEN1CYP1A2CYP2D6 | |
| SCHEMBL2158197 | 0.77 | KDM4E (0.60) | KDM4EKMT2AMEN1CYP1A2CYP2D6 | |
| SCHEMBL17858405 | 0.75 | KDM4E (0.55) | KDM4EKMT2AMEN1CYP1A2CYP2D6 | |
| SCHEMBL17842078 | 0.75 | LTA4H (0.57) | KDM4EKMT2AMEN1CYP1A2CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2015095701-A1 | SUBSTITUTED AMINO TRIAZOLES, AND METHODS USING SAME | THE INSTITUTE FOR DRUG DELIVERY (US) | 2015-06-25 | — | — | WO | disclosed |