Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | FAAH | O00519 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.33 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.33 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.32 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL3073945 | 0.87 | SSTR4 (0.34) | ESR1ESR2MAPTSLC6A2SLC6A4 | |
| SCHEMBL3094904 | 0.84 | MCHR1 (0.38) | SLC6A2SLC6A4SLC6A3KMT2AMCHR1 | |
| SCHEMBL3083318 | 0.82 | MCHR1 (0.37) | ESR2MAPTSLC6A4CYP2D6HTR2C | |
| SCHEMBL3069862 | 0.77 | SLC6A4 (0.39) | ESR1ESR2MAPTSMN1; SMN2SLC6A2 | |
| SCHEMBL3081696 | 0.76 | MCHR1 (0.40) | ESR1ESR2MAPTSMN1; SMN2FAAH | |
| SCHEMBL3079184 | 0.74 | MMP13 (0.44) | MAPTFAAHSLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3083522 | 0.72 | KMT2A (0.38) | MAPTSMN1; SMN2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3083463 | 0.72 | DRD2 (0.48) | MAPTSMN1; SMN2SLC6A2SLC6A4SLC6A3 | |
| SCHEMBL3089358 | 0.71 | SLC9A3 (0.44) | SLC6A4HTR2CMCHR1HTR2A | |
| SCHEMBL3090257 | 0.71 | MAP4K1 (0.42) | — |
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-2146720-A1 | ARYLOXY-AND HETEROARYLOXY-SUBSTITUTED TETRAHYDROBENZAZEPINES AND USE THEREOF TO BLOCK REUPTAKE OF NOREPINEPHRINE, DOPAMINE, AND SEROTONIN | AMR Technology, Inc. (US) | 2010-01-27 | — | — | EP | disclosed |
| WO-2008141082-A1 | ARYLOXY-AND HETEROARYLOXY-SUBSTITUTED TETRAHYDROBENZAZEPINES AND USE THEREOF TO BLOCK REUPTAKE OF NOREPINEPHRINE, DOPAMINE, AND SEROTONIN | AMR TECHNOLOGY, INC. (US) | 2008-11-20 | — | — | WO | disclosed |