Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 7/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 8/20 | 0.39 |
| ▸ | HTT | P42858 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | NMBR | P28336 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.33 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.33 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2071508 | 0.83 | HTR2A (0.43) | SLC6A2CYP2D6SLC6A4KCNH2HTR2A | |
| SCHEMBL2074732 | 0.81 | CYP2D6 (0.57) | SLC6A2CYP2D6SLC6A4KCNH2HTR2A | |
| SCHEMBL3160102 | 0.77 | MTNR1A (0.40) | HTR2AALDH1A1HTR1AKDM4EMAPT | |
| Ammonia Solution, Strong SCHEMBL5199276 | 0.73 | HTR2A (0.43) | HTR2AALDH1A1HTR1AGPR84MAPT | |
| SCHEMBL3230396 | 0.71 | OPRL1 (0.42) | MAPK1GPR84BCHE | |
| SCHEMBL2073706 | 0.71 | HDAC3 (0.44) | SLC6A2CYP2D6SLC6A4KCNH2HTR2A | |
| SCHEMBL25075602 | 0.70 | GPR84 (0.42) | SLC6A2CYP2D6SLC6A4KCNH2HTR2A | |
| SCHEMBL2071662 | 0.69 | MTNR1A (0.42) | HTR2AALDH1A1KDM4EMAPT | |
| SCHEMBL157001 | 0.64 | GPR84 (0.42) | SLC6A2CYP2D6SLC6A4KCNH2HTR2A | |
| SCHEMBL14667572 | 0.64 | TSHR (0.44) | HTTKMT2ALMNAALDH1A1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1756054-B1 | 3-AMINO-1-ARYLPROPYL INDOLES AS MONOAMINE REUPTAKE INHIBITOR | HOFFMANN LA ROCHE (CH) | 2010-03-31 | — | — | EP | disclosed |