Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 4/20 | 0.41 |
| ▸ | INPPL1 | O15357 | 7/20 | 0.39 |
| ▸ | INPP5A | Q14642 | 4/20 | 0.39 |
| ▸ | INPP5B | P32019 | 2/20 | 0.39 |
| ▸ | SRC | P12931 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
| ▸ | AKT1 | P31749 | 1/20 | 0.36 |
| ▸ | CDK4 | P11802 | 2/20 | 0.35 |
| ▸ | CCND1 | P24385 | 2/20 | 0.35 |
| ▸ | GSK3A | P49840 | 2/20 | 0.35 |
| ▸ | GSK3B | P49841 | 2/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.35 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28295682 | 0.76 | GPR84 (0.67) | GPR84INPPL1INPP5AINPP5BSRC | |
| SCHEMBL1029435 | 0.73 | ALDH1A1 (0.42) | ALDH1A1KDM4EMAPTNPSR1CDK4 | |
| SCHEMBL8094182 | 0.73 | GSK3B (0.36) | GPR84ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL8080577 | 0.73 | CDK4 (0.36) | GPR84ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL1756365 | 0.73 | TRPM4 (0.48) | MAPTCDK4CCND1GSK3AGSK3B | |
| SCHEMBL297203 | 0.73 | MAPT (0.53) | GPR84INPPL1INPP5AINPP5BSRC | |
| SCHEMBL789452 | 0.71 | TRPM4 (0.47) | MAPTCDK4CCND1GSK3AGSK3B | |
| SCHEMBL1516404 | 0.70 | ADORA2A (0.35) | ALDH1A1MAPTNPSR1CDK4CCND1 | |
| SCHEMBL9438223 | 0.70 | NQO2 (0.48) | GPR84INPPL1INPP5AINPP5BSRC | |
| SCHEMBL6848266 | 0.69 | CDK4 (0.42) | GPR84ALDH1A1KDM4EMAPTCDK4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002047679-A2 | NONPEPTIDE AGONISTS AND ANTAGONISTS OF VASOPRESSIN RECEPTORS | EMORY UNIVERSITY (US) | 2002-06-20 | — | — | WO | disclosed |