Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | HTR7 | P34969 | 2/20 | 0.42 |
| ▸ | HTR2B | P41595 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | CDK4 | P11802 | 1/20 | 0.38 |
| ▸ | CCND1 | P24385 | 1/20 | 0.38 |
| ▸ | DRD2 | P14416 | 3/20 | 0.37 |
| ▸ | DRD3 | P35462 | 2/20 | 0.37 |
| ▸ | DRD1 | P21728 | 1/20 | 0.37 |
| ▸ | DRD5 | P21918 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 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 | |
|---|---|---|---|---|
| SCHEMBL5999294 | 1.00 | PNMT (0.47) | PNMTTSHRCYP3A4HTR7HTR2B | |
| Acetonitrile SCHEMBL28758116 | 0.91 | PNMT (0.41) | PNMTTSHRCYP3A4HTR7HTR2B | |
| SCHEMBL30015218 | 0.80 | PNMT (0.47) | PNMTTSHRCYP3A4HTR7HTR2B | |
| SCHEMBL10946081 | 0.80 | PNMT (0.44) | PNMTTSHRCYP3A4HTR7HTR2B | |
| SCHEMBL10685341 | 0.80 | PNMT (0.47) | PNMTTSHRCYP3A4HTR7HTR2B | |
| SCHEMBL28066886 | 0.80 | PNMT (0.58) | PNMTTSHRCYP3A4HTR7HTR2B | |
| SCHEMBL58474 | 0.80 | PNMT (0.58) | PNMTTSHRCYP3A4HTR7HTR2B | |
| SCHEMBL9123572 | 0.80 | HTR2B (0.46) | PNMTTSHRCYP3A4HTR7HTR2B | |
| SCHEMBL4855313 | 0.79 | CA1 (0.42) | PNMTTSHRCYP3A4HTR7HTR2B | |
| Hydrochloric Acid SCHEMBL29546213 | 0.79 | PNMT (0.42) | PNMTTSHRCYP3A4HTR7HTR2B |
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 |
|---|---|---|---|---|---|---|---|
| CN-110636884-B | Novel crystalline forms | 吉利德科学公司 | 2022-10-04 | — | — | CN | disclosed |