Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 2/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | FFAR1 | O14842 | 12/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HBB | P68871 | 1/20 | 0.42 |
| ▸ | HTR1A | P08908 | 1/20 | 0.42 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | DRD4 | P21917 | 1/20 | 0.42 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.42 |
| ▸ | HTR2C | P28335 | 1/20 | 0.42 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.42 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.40 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11230966 | 0.94 | CA2 (0.56) | CA2CA1FFAR1MAPTHBB | |
| SCHEMBL15864967 | 0.87 | CA2 (0.58) | CA2CA1FFAR1HTR1ADRD2 | |
| SCHEMBL15864969 | 0.87 | CA2 (0.58) | CA2CA1FFAR1HTR1ADRD2 | |
| SCHEMBL6761878 | 0.84 | CA2 (0.59) | CA2CA1FFAR1MAPTHBB | |
| SCHEMBL11025999 | 0.82 | CA2 (0.59) | CA2CA1FFAR1HTR1ADRD2 | |
| SCHEMBL11235851 | 0.81 | CA2 (0.56) | CA2FFAR1MAPTHTTMTNR1A | |
| SCHEMBL16089590 | 0.81 | CA2 (0.58) | CA2CA1FFAR1HTR1ADRD2 | |
| SCHEMBL440872 | 0.81 | CA2 (0.62) | CA2CA1FFAR1HTR1ADRD2 | |
| SCHEMBL1044791 | 0.81 | CA2 (0.58) | CA2CA1FFAR1MAPTHBB | |
| SCHEMBL4764921 | 0.81 | CA2 (0.62) | CA2CA1FFAR1HTR1ADRD2 |
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-4353901-A | HYPERTENSION, CONGESTIVE HEART FAILURE, ARRHYTHMIAMIGRAINE, VASOSPASTIC DISORDERS, ASTHMA | SYNTEX (U.S.A.) INC. (US) | 1982-10-12 | — | — | US | disclosed |