Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.40 |
| ▸ | HTR1D | P28221 | 1/20 | 0.40 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.39 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.37 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.36 |
| ▸ | CDK4 | P11802 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1399414 | 0.85 | HTR2A (0.55) | HTR2AALDH1A1HTR6KDM4EADRB2 | |
| SCHEMBL1399330 | 0.83 | MEN1 (0.43) | HTR2AALDH1A1KDM4EGPR84SLC6A2 | |
| SCHEMBL1399337 | 0.78 | HTR2A (0.55) | HTR2AALDH1A1HTR6KDM4EADRB2 | |
| SCHEMBL13548601 | 0.74 | KDM4E (0.48) | HTR2AALDH1A1KDM4EGPR84L3MBTL1 | |
| SCHEMBL5923660 | 0.73 | ADRB2 (0.64) | HTR2AALDH1A1HTR6KDM4EADRB2 | |
| SCHEMBL332959 | 0.72 | HTR2A (1.00) | HTR2AHTR6KDM4EADRB2HTR1D | |
| Hydrochloric Acid SCHEMBL16592500 | 0.72 | ADRB2 (0.62) | HTR2AALDH1A1HTR6KDM4EADRB2 | |
| Hydrochloric Acid SCHEMBL11708514 | 0.70 | ALDH1A1 (0.60) | HTR2AALDH1A1KDM4EGPR84MEN1 | |
| SCHEMBL16597937 | 0.70 | HTR2A (0.61) | HTR2AALDH1A1HTR6KDM4EADRB2 | |
| SCHEMBL1399321 | 0.70 | PTGS2 (0.48) | HTR2AALDH1A1KDM4EMEN1KMT2A |
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-1860100-B1 | 2-(1H-indolylsulfanyl)-benzyl amine derivatives as SSRI | LUNDBECK & CO AS H (DK) | 2011-03-02 | — | — | EP | claimed |