Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNKS | O95271 | 4/20 | 0.48 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.46 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.45 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.45 |
| ▸ | HTR3A | P46098 | 2/20 | 0.42 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.41 |
| ▸ | ALK | Q9UM73 | 1/20 | 0.41 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.40 |
| ▸ | FLT1 | P17948 | 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 | |
|---|---|---|---|---|
| SCHEMBL21463922 | 0.86 | ALDH1A1 (0.54) | TNKSHSP90AA1HSP90AB1OPRM1OPRL1 | |
| SCHEMBL30615497 | 0.86 | ALDH1A1 (0.54) | TNKSHSP90AA1HSP90AB1OPRM1OPRL1 | |
| SCHEMBL30615558 | 0.85 | HTR7 (0.47) | TNKSOPRM1OPRL1HTR7 | |
| SCHEMBL21464150 | 0.85 | HTR7 (0.47) | TNKSOPRM1OPRL1HTR7 | |
| SCHEMBL28487647 | 0.83 | PARP1 (0.49) | TNKSPARP1HTR3AHTR7HRH4 | |
| SCHEMBL28488291 | 0.81 | TNKS (0.48) | TNKSAURKAALDH1A1 | |
| SCHEMBL28488276 | 0.81 | TNKS (0.48) | TNKSHSP90AA1AURKA | |
| SCHEMBL28492211 | 0.81 | TNKS (0.48) | TNKSHSP90AA1OPRM1OPRL1AURKA | |
| SCHEMBL21464096 | 0.80 | TNKS (0.45) | TNKSAURKA | |
| SCHEMBL21464095 | 0.80 | TNKS (0.45) | TNKSAURKA |
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 2 patents. 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 |
| CN-111868037-A | Fused cyclic urea derivatives as CRHR2 antagonists | 拉夸里亚创药株式会社 | 2020-10-30 | — | — | CN | disclosed |