Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 2/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.43 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.43 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.41 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.41 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.41 |
| ▸ | NRAS | P01111 | 3/20 | 0.40 |
| ▸ | FLT3 | P36888 | 3/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | CDK7 | P50613 | 2/20 | 0.40 |
| ▸ | CCNH | P51946 | 2/20 | 0.40 |
| ▸ | MNAT1 | P51948 | 1/20 | 0.40 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29862464 | 1.00 | HTR1A (0.43) | HTR1AADRA1DADRA1AADRA1BRPS6KB1 | |
| Hydrochloric Acid SCHEMBL23360362 | 0.99 | HTR1A (0.42) | HTR1AADRA1DADRA1AADRA1BRPS6KB1 | |
| Hydrochloric Acid SCHEMBL23360488 | 0.99 | HTR1A (0.42) | HTR1AADRA1DADRA1AADRA1BRPS6KB1 | |
| Hydrochloric Acid SCHEMBL23360360 | 0.99 | HTR1A (0.42) | HTR1AADRA1DADRA1AADRA1BRPS6KB1 | |
| Hydrochloric Acid SCHEMBL23360663 | 0.92 | CYP1A2 (0.46) | HTR1AADRA1DADRA1AADRA1BPDE4D | |
| SCHEMBL29862532 | 0.91 | HTR1A (0.55) | HTR1AADRA1DADRA1AADRA1BRPS6KB1 | |
| Hydrochloric Acid SCHEMBL23360308 | 0.89 | HTR1A (0.54) | HTR1AADRA1DADRA1AADRA1BRPS6KB1 | |
| Hydrochloric Acid SCHEMBL23360306 | 0.89 | HTR1A (0.54) | HTR1AADRA1DADRA1AADRA1BRPS6KB1 | |
| SCHEMBL29862421 | 0.88 | DGAT2 (0.42) | RPS6KB1ALDH1A1CYP2C19KDM4EHPGD | |
| Hydrochloric Acid SCHEMBL23360299 | 0.87 | DGAT2 (0.41) | RPS6KB1ALDH1A1CYP2C19KDM4EHPGD |
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-114867719-A | Pyrrolidine and piperidine compounds | 柳韩洋行 | 2022-08-05 | — | — | CN | disclosed |