Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 4/20 | 0.67 |
| ▸ | MAPT | P10636 | 3/20 | 0.67 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.67 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.67 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.67 |
| ▸ | RAB9A | P51151 | 1/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.66 |
| ▸ | APEX1 | P27695 | 1/20 | 0.66 |
| ▸ | BLM | P54132 | 1/20 | 0.66 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.66 |
| ▸ | MEN1 | O00255 | 4/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | GAA | P10253 | 3/20 | 0.52 |
| ▸ | GFER | P55789 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | PKM | P14618 | 2/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA1 | P00915 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7837566 | 0.89 | HTR6 (0.74) | HTR6MAPTALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL7836254 | 0.82 | HTR6 (0.76) | HTR6MAPTALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL7824884 | 0.81 | HTR6 (0.74) | HTR6MAPTALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL678897 | 0.81 | HTR6 (1.00) | HTR6MAPTALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL7824099 | 0.81 | HTR6 (0.74) | HTR6MAPTALDH1A1CYP3A4CYP2C9 | |
| Hydrochloric Acid SCHEMBL8054947 | 0.80 | MAPT (1.00) | HTR6MAPTALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL7836431 | 0.78 | ALDH1A1 (0.71) | HTR6MAPTALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL11317375 | 0.78 | LMNA (0.54) | MAPTRAB9AKDM4ENPSR1MEN1 | |
| SCHEMBL7825681 | 0.77 | HTR6 (0.57) | HTR6MAPTALDH1A1CYP3A4CYP2C9 | |
| SCHEMBL7835675 | 0.75 | HTR6 (0.61) | HTR6MAPTALDH1A1CYP3A4CYP2C9 |
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-1893202-A2 | MULTIMEDIATOR DOPAMINE TRANSPORT INHIBITORS, AND USES RELATED THERETO | PREXA PHARMACEUTICALS, INC. (US) | 2008-03-05 | — | — | EP | disclosed |
| WO-2006091702-A2 | MULTIMEDIATOR DOPAMINE TRANSPORT INHIBITORS, AND USES RELATED THERETO | PSYCHENOMICS, INC. (US) | 2006-08-31 | — | — | WO | disclosed |