Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.44 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.42 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.42 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.42 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.42 |
| ▸ | KIF11 | P52732 | 6/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20184852 | 1.00 | CYP2D6 (0.46) | CYP2D6CYP1A2MAPTKMT2ACYP2C19 | |
| SCHEMBL20184853 | 1.00 | CYP2D6 (0.46) | CYP2D6CYP1A2MAPTKMT2ACYP2C19 | |
| SCHEMBL17582896 | 1.00 | CYP2D6 (0.46) | CYP2D6CYP1A2MAPTKMT2ACYP2C19 | |
| SCHEMBL10905882 | 0.84 | KIF11 (0.42) | CYP2D6MAPTKMT2AHIF1AHDAC1 | |
| SCHEMBL7248371 | 0.81 | KMT2A (0.47) | CYP2D6CYP1A2MAPTKMT2ACYP2C19 | |
| SCHEMBL27583111 | 0.81 | CYP2D6 (0.47) | CYP2D6CYP1A2MAPTKMT2ACYP2C19 | |
| SCHEMBL4365780 | 0.81 | CYP1A2 (0.47) | CYP2D6CYP1A2MAPTKMT2ACYP2C19 | |
| SCHEMBL430340 | 0.81 | CYP1A2 (0.47) | CYP2D6CYP1A2MAPTKMT2ACYP2C19 | |
| SCHEMBL11025648 | 0.80 | CYP2D6 (0.43) | CYP2D6CYP1A2MAPTKMT2ACYP2C19 | |
| SCHEMBL31555500 | 0.80 | CYP2C19 (0.46) | CYP2D6CYP1A2MAPTKMT2ACYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| US-5132457-A | Stereospecific synthesis of 2(R)-2-methyl-3-dimethylamino-propiophenone (d-DAMP) | MALLINCKRODT SPECIALTY CHEMICALS COMPANY (US) | 1992-07-21 | — | — | US | disclosed |