Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM4 | Q14833 | 1/20 | 0.44 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | WRN | Q14191 | 1/20 | 0.38 |
| ▸ | TRPV4 | Q9HBA0 | 2/20 | 0.37 |
| ▸ | PGR | P06401 | 2/20 | 0.36 |
| ▸ | BUB1 | O43683 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | ACLY | P53396 | 1/20 | 0.33 |
| ▸ | CNR2 | P34972 | 1/20 | 0.33 |
| ▸ | EGFR | P00533 | 2/20 | 0.32 |
| ▸ | AKT1 | P31749 | 1/20 | 0.32 |
| ▸ | PTP4A3 | O75365 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21919186 | 0.81 | GRM4 (0.44) | GRM4ABCG2BLMWRNTRPV4 | |
| SCHEMBL3173181 | 0.79 | GRM4 (0.48) | GRM4ABCG2BLMWRNTRPV4 | |
| SCHEMBL19190440 | 0.77 | GRM4 (0.50) | GRM4ABCG2BLMWRNTRPV4 | |
| SCHEMBL21844923 | 0.77 | GRM4 (0.47) | GRM4ABCG2BLMWRNTRPV4 | |
| SCHEMBL897882 | 0.77 | GRM4 (0.47) | GRM4ABCG2BLMWRNTRPV4 | |
| Hydrochloric Acid SCHEMBL1765566 | 0.76 | GRM4 (0.46) | GRM4ABCG2BLMWRNTRPV4 | |
| SCHEMBL7230699 | 0.76 | GRM4 (0.46) | GRM4ABCG2BLMWRNTRPV4 | |
| Hydrochloric Acid SCHEMBL3829463 | 0.74 | GRM4 (0.48) | GRM4ABCG2BLMWRNTRPV4 | |
| Hydrochloric Acid SCHEMBL7475755 | 0.74 | GRM4 (0.48) | GRM4ABCG2BLMWRNTRPV4 | |
| SCHEMBL14730465 | 0.74 | GRM4 (0.48) | GRM4ABCG2BLMWRNTRPV4 |
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 |
|---|---|---|---|---|---|---|---|
| US-6548512-B1 | Pyrazole derivatives such as 1-(3-amidinophenyl)-3-methyl-2-((5-(2'-aminosulfonylphenyl-1-yl)pyrimidin-2 -yl)aminocarbonyl)pyrazole; treating thromboembolic disorders | BRISTOL-MYERS SQUIBB PHARMA COMPANY | 2003-04-15 | — | — | US | disclosed |
| US-6020357-A | CARDIOVASCULAR DISORDERS; ANTCOAGULANTS | DUPONT PHARMACEUTICALS COMPANY (US) | 2000-02-01 | — | — | US | disclosed |