Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB11 | O95342 | 5/20 | 0.46 |
| ▸ | CACNA1C | Q13936 | 5/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.46 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 4/20 | 0.46 |
| ▸ | SCN5A | Q14524 | 4/20 | 0.46 |
| ▸ | TBXA2R | P21731 | 3/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.46 |
| ▸ | DRD3 | P35462 | 3/20 | 0.46 |
| ▸ | DRD1 | P21728 | 3/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 3/20 | 0.46 |
| ▸ | HTR2B | P41595 | 3/20 | 0.46 |
| ▸ | HTR1A | P08908 | 2/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.46 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.46 |
| ▸ | KCNK2 | O95069 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7385243 | 0.94 | CYP2C9 (0.53) | ABCB11CACNA1CADRA1AOPRM1KCNH2 | |
| SCHEMBL7383940 | 0.92 | ABCB11 (0.46) | ABCB11CACNA1CADRA1AOPRM1KCNH2 | |
| SCHEMBL7381706 | 0.92 | KDM4E (0.48) | ABCB11CACNA1CADRA1AOPRM1KCNH2 | |
| SCHEMBL7382902 | 0.89 | CYP2C9 (0.49) | ABCB11CACNA1CADRA1AOPRM1KCNH2 | |
| SCHEMBL7379245 | 0.89 | CYP2C9 (0.49) | ABCB11CACNA1CADRA1AOPRM1KCNH2 | |
| SCHEMBL7381104 | 0.89 | ABCB11 (0.51) | ABCB11CACNA1CADRA1AOPRM1KCNH2 | |
| SCHEMBL7376086 | 0.88 | ABCB11 (0.48) | ABCB11CACNA1CADRA1AOPRM1KCNH2 | |
| SCHEMBL7387981 | 0.88 | CYP2C9 (0.44) | ABCB11CACNA1CADRA1AOPRM1KCNH2 | |
| SCHEMBL7375485 | 0.87 | KDM4E (0.53) | ABCB11CACNA1CADRA1AOPRM1KCNH2 | |
| SCHEMBL7384438 | 0.87 | CYP2C9 (0.46) | ABCB11CACNA1CADRA1AOPRM1KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-4889866-A | CARDIOVASCULAR DISEASES, HYPOTENSIVE AGENTS, CONGESTIVE HEART FAILURE | SYNTEX (U.S.A.) INC. (US) | 1989-12-26 | — | — | US | disclosed |