Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.46 |
| ▸ | HRH1 | P35367 | 2/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 5/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.39 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.38 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.38 |
| ▸ | HTR1B | P28222 | 1/20 | 0.37 |
| ▸ | MTOR | P42345 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.37 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9857036 | 0.89 | HTR2A (0.49) | HTR2AHRH1TAAR1ATMSLC6A4 | |
| SCHEMBL9856456 | 0.87 | HTR2A (0.50) | HTR2AHRH1TAAR1ATMSLC6A4 | |
| SCHEMBL8384207 | 0.83 | HTR2A (0.60) | HTR2AHRH1TAAR1ATMSLC6A4 | |
| SCHEMBL9856887 | 0.83 | HTR2A (0.49) | HTR2AHRH1TAAR1ATMSLC6A4 | |
| SCHEMBL9857077 | 0.83 | HTR2A (0.49) | HTR2AHRH1TAAR1ATMSLC6A4 | |
| Oxalic Acid SCHEMBL10595045 | 0.83 | CTSB (0.46) | HTR2AHRH1SLC6A4CYP2D6SLC6A2 | |
| SCHEMBL9856758 | 0.82 | HTR2A (0.45) | HTR2AHRH1TAAR1ATMSLC6A4 | |
| SCHEMBL9856737 | 0.82 | SLC6A4 (0.54) | HTR2AHRH1TAAR1SLC6A4SLC6A2 | |
| SCHEMBL9856768 | 0.82 | TAAR1 (0.54) | HTR2AHRH1TAAR1ATMSLC6A4 | |
| SCHEMBL9856763 | 0.81 | SLC6A4 (0.44) | HTR2AHRH1SLC6A4CYP2D6L3MBTL1 |
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-4996235-A | Selectively inhibiting the uptake of serotonin and norepinephrine | ELI LILLY AND COMPANY (US) | 1991-02-26 | — | — | US | disclosed |