Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 5/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.36 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | HTR2A | P28223 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | MET | P08581 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 4/20 | 0.34 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.34 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.34 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29688968 | 0.81 | HTR2C (0.46) | HTR2CSLC6A4DRD2SLC6A2SLC6A3 | |
| SCHEMBL4503187 | 0.81 | HTR2C (0.46) | HTR2CSLC6A4DRD2SLC6A2SLC6A3 | |
| Hydrochloric Acid SCHEMBL8916365 | 0.80 | HTR2C (0.47) | HTR2CSLC6A4DRD2SLC6A2SLC6A3 | |
| SCHEMBL4491304 | 0.78 | KCNH2 (0.45) | PTPN1HTR2CSLC6A4SLC6A2SLC6A3 | |
| SCHEMBL29688867 | 0.78 | KCNH2 (0.45) | PTPN1HTR2CSLC6A4SLC6A2SLC6A3 | |
| SCHEMBL8548591 | 0.78 | HTR2C (0.39) | HTR2CSLC6A4DRD2CHRNB2CHRNA4 | |
| Hydrochloric Acid SCHEMBL7694678 | 0.77 | MPO (0.46) | PTPN1HTR2CSLC6A4SLC6A2SLC6A3 | |
| SCHEMBL20809221 | 0.75 | HTR2C (0.49) | HTR2CSLC6A4DRD2SLC6A2 | |
| SCHEMBL13584551 | 0.74 | SLC6A4 (0.55) | HTR2CSLC6A4DRD2HTR2ADRD3 | |
| SCHEMBL7966309 | 0.74 | MAPK14 (0.40) | HTR2ATLR9TLR8TLR7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021003314-A1 | HETEROCYCLIC COMPOUNDS AS KINASE INHIBITORS | NUVATION BIO INC. (US) | 2021-01-07 | — | — | WO | disclosed |
| US-6303627-B1 | FOR THERAPY OF PHYSIOLOGICAL AND PSYCHOLOGICAL DISORDERS | ELI LILLY AND COMPANY | 2001-10-16 | — | — | US | disclosed |
| EP-0965587-A1 | Tetrahydropyridinyl- and piperidinyl Inhibitors of serotonin reuptake | ELI LILLY AND COMPANY (US) | 1999-12-22 | — | — | EP | disclosed |