Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.68 |
| ▸ | HTR2C | P28335 | 1/20 | 0.68 |
| ▸ | HTR2B | P41595 | 1/20 | 0.68 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.44 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.44 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.44 |
| ▸ | MME | P08473 | 1/20 | 0.44 |
| ▸ | ACE | P12821 | 1/20 | 0.44 |
| ▸ | CPA1 | P15085 | 1/20 | 0.44 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.44 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.44 |
| ▸ | TACR1 | P25103 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL31054190 | 0.82 | HTR2A (1.00) | HTR2AHTR2CHTR2BSLC6A2TAAR1 | |
| SCHEMBL31054149 | 0.82 | HTR2A (1.00) | HTR2AHTR2CHTR2BSLC6A2TAAR1 | |
| SCHEMBL17413319 | 0.82 | HTR2A (1.00) | HTR2AHTR2CHTR2BSLC6A2TAAR1 | |
| SCHEMBL268036 | 0.82 | HTR2A (1.00) | HTR2AHTR2CHTR2BSLC6A2TAAR1 | |
| Hydrochloric Acid SCHEMBL5962875 | 0.81 | HTR2A (0.96) | HTR2AHTR2CHTR2BSLC6A2TAAR1 | |
| SCHEMBL23979286 | 0.77 | HTR2A (0.89) | HTR2AHTR2CHTR2BSLC6A2TAAR1 | |
| Naphthalene SCHEMBL27919297 | 0.77 | NR4A1 (0.55) | HTR2A | |
| Naphthalene SCHEMBL27264766 | 0.77 | NR4A1 (0.59) | HTR2A | |
| SCHEMBL24548518 | 0.76 | HTR2A (0.68) | HTR2AHTR2CHTR2BSLC1A3SLC1A2 | |
| Naphthalene SCHEMBL27525627 | 0.75 | NR4A1 (0.57) | HTR2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-102056897-B | Sulfonamide compound and application thereof | ASAHI KASEI PHARMA CORP | 2014-05-07 | — | — | CN | disclosed |
| CN-103570630-A | Heterocyclic nitrogen derivative and application thereof in medicines | GUANGDONG HEC PHARMACEUTICAL | 2014-02-12 | — | — | CN | disclosed |
| CN-102056897-A | Sulfonamide compound and application thereof | ASAHI KASEI PHARMA CORP | 2011-05-11 | — | — | CN | disclosed |