Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRG2 | P18507 | 17/20 | 0.62 |
| ▸ | GABRB3 | P28472 | 17/20 | 0.62 |
| ▸ | GABRA1 | P14867 | 16/20 | 0.62 |
| ▸ | GABRA3 | P34903 | 15/20 | 0.62 |
| ▸ | GABRA5 | P31644 | 10/20 | 0.62 |
| ▸ | GABRA2 | P47869 | 5/20 | 0.62 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | FLT3 | P36888 | 1/20 | 0.35 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.34 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.34 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
| ▸ | CDK9 | P50750 | 1/20 | 0.34 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.34 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.34 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7225937 | 1.00 | GABRG2 (0.62) | GABRG2GABRB3GABRA1GABRA3GABRA5 | |
| SCHEMBL7224559 | 0.80 | GABRA1 (0.70) | GABRG2GABRB3GABRA1GABRA3GABRA5 | |
| SCHEMBL7224413 | 0.78 | GABRA1 (0.67) | GABRG2GABRB3GABRA1GABRA3GABRA5 | |
| SCHEMBL2659147 | 0.77 | GABRA1 (1.00) | GABRG2GABRB3GABRA1GABRA3GABRA5 | |
| SCHEMBL7231276 | 0.77 | GABRA1 (0.66) | GABRG2GABRB3GABRA1GABRA3GABRA5 | |
| SCHEMBL7234152 | 0.75 | GABRA1 (0.60) | GABRG2GABRB3GABRA1GABRA3GABRA5 | |
| SCHEMBL7226062 | 0.74 | GABRG2 (0.62) | GABRG2GABRB3GABRA1GABRA3GABRA5 | |
| SCHEMBL7231057 | 0.74 | GABRA1 (0.68) | GABRG2GABRB3GABRA1GABRA3GABRA5 | |
| SCHEMBL7231054 | 0.74 | GABRA1 (0.68) | GABRG2GABRB3GABRA1GABRA3GABRA5 | |
| SCHEMBL7232228 | 0.74 | GABRG2 (0.61) | GABRG2GABRB3GABRA1GABRA3GABRA5 |
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-6642229-B2 | Treatment of adverse neurological conditions | MERCK SHARP & DOHME LTD. | 2003-11-04 | — | — | US | claimed |
| US-6642229-B2 | Treatment of adverse neurological conditions | MERCK SHARP & DOHME LTD. | 2003-11-04 | — | — | US | disclosed |