Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.64 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | HMGCR | P04035 | 1/20 | 0.51 |
| ▸ | CA2 | P00918 | 2/20 | 0.51 |
| ▸ | DRD2 | P14416 | 2/20 | 0.51 |
| ▸ | DRD1 | P21728 | 2/20 | 0.51 |
| ▸ | DRD4 | P21917 | 2/20 | 0.51 |
| ▸ | DRD3 | P35462 | 2/20 | 0.51 |
| ▸ | CA9 | Q16790 | 2/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.51 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.51 |
| ▸ | CA12 | O43570 | 1/20 | 0.51 |
| ▸ | CA1 | P00915 | 1/20 | 0.51 |
| ▸ | CA3 | P07451 | 1/20 | 0.51 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.51 |
| ▸ | MAPT | P10636 | 1/20 | 0.51 |
| ▸ | CA6 | P23280 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7912419 | 0.87 | GAA (0.63) | GAAMEN1KMT2ACA2DRD2 | |
| SCHEMBL7911338 | 0.87 | GAA (0.63) | GAAMEN1KMT2ACA2DRD2 | |
| SCHEMBL7904015 | 0.85 | HMGCR (0.47) | GAAMEN1KMT2AHMGCRDRD2 | |
| SCHEMBL7913915 | 0.84 | GAA (0.47) | GAAMEN1KMT2ACA2CA9 | |
| SCHEMBL7144405 | 0.83 | GAA (0.65) | GAAMEN1KMT2ACA2DRD2 | |
| SCHEMBL11408239 | 0.83 | GAA (0.65) | GAAMEN1KMT2ACA2DRD2 | |
| SCHEMBL29598834 | 0.83 | GAA (0.65) | GAAMEN1KMT2ACA2DRD2 | |
| SCHEMBL131628 | 0.83 | GAA (0.65) | GAAMEN1KMT2ACA2DRD2 | |
| SCHEMBL10723872 | 0.82 | GAA (0.78) | GAAMEN1KMT2ACA2DRD2 | |
| SCHEMBL13545228 | 0.82 | NLRP3 (0.50) | GAAHMGCRCA2DRD2DRD3 |
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-7645771-B2 | CCR5 antagonists as therapeutic agents | SMITHKLINE BEECHAM CORP. (US) | 2010-01-12 | — | — | US | disclosed |
| US-6214882-B1 | Benzenesulphonamide derivatives, preparation thereof and therapeutical uses thereof | SYNTHELABO (FR) | 2001-04-10 | — | — | US | disclosed |