Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 3/20 | 0.40 |
| ▸ | DRD1 | P21728 | 2/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 9/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.39 |
| ▸ | DRD4 | P21917 | 2/20 | 0.36 |
| ▸ | DRD5 | P21918 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | RECQL | P46063 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL16582899 | 0.85 | DRD2 (0.44) | DRD2DRD1HTR2AHTR2CESR1 | |
| SCHEMBL6653153 | 0.83 | HTR2C (0.38) | HTR2AHTR2CESR1ESR2 | |
| SCHEMBL6650634 | 0.82 | ALDH1A1 (0.39) | DRD2DRD1HTR2AHTR2CALDH1A1 | |
| SCHEMBL2477900 | 0.82 | HTR2A (0.58) | HTR2AHTR2C | |
| SCHEMBL29051751 | 0.76 | HTR2A (0.59) | DRD2DRD1HTR2AHTR2CESR1 | |
| SCHEMBL6532681 | 0.75 | HTR2C (0.49) | DRD1HTR2AHTR2CDRD5 | |
| SCHEMBL2365900 | 0.73 | HTR2A (0.51) | HTR2AHTR2C | |
| SCHEMBL6631310 | 0.72 | FGFR4 (0.35) | HTR2AHTR2CALDH1A1LMNAMAPT | |
| Trifluoroacetic Acid SCHEMBL4915477 | 0.72 | DRD2 (0.59) | DRD2DRD1HTR2AHTR2CESR1 | |
| SCHEMBL1907864 | 0.72 | ADRA2A (0.37) | HTR2AHTR2CLMNAHSD17B10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8575149-B2 | 5HT2C receptor modulators | ARENA PHARMACEUTICALS, INC. (US) | 2013-11-05 | — | — | US | disclosed |
| EP-2363394-A1 | 8-Chloro-1-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine, its salts, solvates or hydrates and its use for the treatment of CNS disorders | Arena Pharmaceuticals, Inc. (US) | 2011-09-07 | — | — | EP | disclosed |