Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 2/20 | 0.53 |
| ▸ | HTR2C | P28335 | 2/20 | 0.53 |
| ▸ | HTR2B | P41595 | 2/20 | 0.53 |
| ▸ | NOTUM | Q6P988 | 2/20 | 0.46 |
| ▸ | PNMT | P11086 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 3/20 | 0.40 |
| ▸ | DRD1 | P21728 | 3/20 | 0.40 |
| ▸ | DRD5 | P21918 | 3/20 | 0.40 |
| ▸ | DRD3 | P35462 | 3/20 | 0.40 |
| ▸ | AKR1C3 | P42330 | 2/20 | 0.40 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 2/20 | 0.40 |
| ▸ | SRD5A1 | P18405 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | HSD17B3 | P37058 | 2/20 | 0.38 |
| ▸ | ACACB | O00763 | 1/20 | 0.37 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.37 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.37 |
| ▸ | TAS1R2 | Q8TE23 | 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 | |
|---|---|---|---|---|
| SCHEMBL160943 | 0.81 | HTR2A (0.55) | HTR2AHTR2CHTR2BNOTUMPNMT | |
| SCHEMBL15962624 | 0.79 | — | — | |
| Ammonia Solution, Strong SCHEMBL10465265 | 0.77 | HTR2A (0.67) | HTR2AHTR2CHTR2BPNMTSRD5A1 | |
| SCHEMBL6883015 | 0.76 | MAOA (0.59) | HTR2AHTR2CHTR2BDRD2DRD1 | |
| SCHEMBL11068898 | 0.76 | NOTUM (0.59) | NOTUMHSD17B3 | |
| SCHEMBL5221227 | 0.75 | HTR2A (0.64) | HTR2AHTR2CHTR2BPNMTHTT | |
| SCHEMBL29724224 | 0.75 | HTR2A (0.64) | HTR2AHTR2CHTR2BPNMTHTT | |
| SCHEMBL30218134 | 0.75 | HTR2A (0.64) | HTR2AHTR2CHTR2BPNMTHTT | |
| SCHEMBL5496769 | 0.75 | HTR2A (0.64) | HTR2AHTR2CHTR2BPNMTHTT | |
| SCHEMBL1905997 | 0.75 | DRD2 (0.58) | HTR2AHTR2CHTR2BNOTUMPNMT |
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-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 |