Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 9/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 3/20 | 0.44 |
| ▸ | HTR6 | P50406 | 2/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | TNKS | O95271 | 1/20 | 0.42 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.41 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.41 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.41 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.41 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.40 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 1/20 | 0.40 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL21464150 | 1.00 | HTR7 (0.47) | HTR7GAAHTR1AHTR6DRD2 | |
| SCHEMBL28495324 | 0.85 | TNKS (0.48) | HTR7TNKSOPRM1OPRL1 | |
| SCHEMBL30615497 | 0.81 | ALDH1A1 (0.54) | HTR7GAATNKSOPRM1CHRM1 | |
| SCHEMBL21463922 | 0.81 | ALDH1A1 (0.54) | HTR7GAATNKSOPRM1CHRM1 | |
| SCHEMBL21464106 | 0.77 | TNKS (0.45) | TNKSMAPK8CHRM1KCNH2 | |
| SCHEMBL21464096 | 0.77 | TNKS (0.45) | TNKSMAPK8CHRM1KCNH2 | |
| SCHEMBL30615602 | 0.77 | TNKS (0.45) | TNKSMAPK8CHRM1KCNH2 | |
| SCHEMBL21464095 | 0.77 | TNKS (0.45) | TNKSMAPK8CHRM1KCNH2 | |
| SCHEMBL30615332 | 0.77 | TNKS (0.45) | TNKSMAPK8CHRM1KCNH2 | |
| SCHEMBL28488276 | 0.77 | TNKS (0.48) | TNKSCHRM1 |
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-111868037-B | Fused cyclic urea derivatives as CRHR2 antagonists | 拉夸里亚创药株式会社 | 2023-10-13 | — | — | CN | disclosed |