Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 2/20 | 0.38 |
| ▸ | HTR1D | P28221 | 2/20 | 0.38 |
| ▸ | HTR1B | P28222 | 2/20 | 0.38 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.38 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.38 |
| ▸ | BRD4 | O60885 | 2/20 | 0.35 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.33 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.32 |
| ▸ | KMO | O15229 | 1/20 | 0.32 |
| ▸ | PLK1 | P53350 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | TERT | O14746 | 1/20 | 0.31 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.30 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.30 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4170716 | 0.76 | HTR1A (0.43) | HTR1AHTR1DHTR1BPDE3BPDE3A | |
| SCHEMBL31180323 | 0.75 | PDE3B (0.37) | HTR1AHTR1DHTR1BPDE3BPDE3A | |
| SCHEMBL30336343 | 0.74 | TERT (0.41) | HTR1AHTR1DHTR1BPDE3BPDE3A | |
| SCHEMBL16738955 | 0.74 | BRD4 (0.56) | HTR1AHTR1DHTR1BPDE3BPDE3A | |
| SCHEMBL30336272 | 0.72 | PDE3B (0.35) | PDE3BPDE3ACYP11B1CYP11B2TSHR | |
| SCHEMBL29209037 | 0.72 | PDE3B (0.35) | PDE3BPDE3ACYP11B1CYP11B2TSHR | |
| Hydrochloric Acid SCHEMBL6831442 | 0.69 | HTR1A (0.41) | HTR1AHTR1DHTR1BPDE3BPDE3A | |
| SCHEMBL10442160 | 0.69 | HTR1A (0.42) | HTR1AHTR1DHTR1BPDE3BPDE3A | |
| SCHEMBL11572747 | 0.69 | MEN1 (0.42) | HTR1AHTR1DHTR1BPDE3BPDE3A | |
| SCHEMBL29209156 | 0.69 | PDE3B (0.43) | HTR1APDE3BPDE3ACYP11B1CYP11B2 |
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-116332937-A | Dipeptidyl peptidase I inhibitors and uses thereof | 杭州邦顺制药有限公司 | 2023-06-27 | — | — | CN | disclosed |