Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | SCN9A | Q15858 | 4/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13658314 | 0.90 | CA2 (0.39) | CA2CA1SCN9A | |
| SCHEMBL7513287 | 0.87 | EPHX1 (0.43) | CYP1A2EPHX1SIGMAR1 | |
| SCHEMBL5918485 | 0.82 | LMNA (0.38) | CA2CA1CYP1A2 | |
| SCHEMBL1418870 | 0.80 | LMNA (0.35) | CA2CA1 | |
| SCHEMBL12729671 | 0.79 | NCF1 (0.37) | CA2CA1 | |
| SCHEMBL14359935 | 0.78 | NPC1 (0.39) | CA2CA1HPGD | |
| SCHEMBL27688849 | 0.78 | CA1 (0.32) | CA2CA1 | |
| SCHEMBL1035150 | 0.76 | ALDH1A1 (0.44) | CA2CA1NFE2L2CYP1A2EPHX1 | |
| SCHEMBL18063469 | 0.76 | CA2 (0.44) | CA2CA1NFE2L2SIGMAR1 | |
| SCHEMBL1652222 | 0.74 | EPHX1 (0.40) | EPHX1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003013526-A1 | ANTICOAGULANT COMPOUNDS | MERCK & CO. INC. (US) | 2003-02-20 | — | — | WO | disclosed |
| US-6380230-B1 | FOR THERAPY OF DYSKINESIA, OBESITY, IRRITABLE BOWEL SYNDROME, DISEASES WHOSE TREATMENT REQUIRES STIMULATION OF THE CHOLECYSTOKININ CCK-A RECEPTORS | SANOFI-SYNTHELABO (FR) | 2002-04-30 | — | — | US | disclosed |