Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSD | A5PKW4 | 2/20 | 0.44 |
| ▸ | CNR1 | P21554 | 13/20 | 0.41 |
| ▸ | CDK8 | P49336 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA4 | P22748 | 1/20 | 0.38 |
| ▸ | CA7 | P43166 | 1/20 | 0.38 |
| ▸ | FGFR3 | P22607 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7439496 | 0.82 | PTGS2 (0.45) | — | |
| SCHEMBL2650293 | 0.82 | PTDSS1 (0.38) | CNR1MAPT | |
| SCHEMBL2649310 | 0.81 | CSNK2A1 (0.42) | PSDMAPT | |
| SCHEMBL2649769 | 0.81 | DHODH (0.44) | CNR1MAPT | |
| SCHEMBL2648853 | 0.79 | GAA (0.39) | PSDMAPTCA1CA2KDR | |
| SCHEMBL2649751 | 0.79 | KIT (0.40) | PSDMAPTKDR | |
| SCHEMBL2650770 | 0.78 | GAA (0.47) | MAPTCA1CA2KDR | |
| SCHEMBL2651418 | 0.78 | ABCB1 (0.43) | PSDMAPTKDR | |
| Hydrochloric Acid SCHEMBL2662150 | 0.77 | GAA (0.46) | MAPTCA1CA2KDR | |
| SCHEMBL2649448 | 0.77 | DHODH (0.40) | MAPTKDR |
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-6333336-B1 | GAMMA-AMINOBUTYRIC ACID RECEPTORS AS ANTICONVULSANTS FORMING THE COMPOUND BY AMIDATION | MERCK SHARP & DOHME LTD. (GB) | 2001-12-25 | — | — | US | claimed |
| US-6333336-B1 | GAMMA-AMINOBUTYRIC ACID RECEPTORS AS ANTICONVULSANTS FORMING THE COMPOUND BY AMIDATION | MERCK SHARP & DOHME LTD. (GB) | 2001-12-25 | — | — | US | disclosed |