Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 2/20 | 0.40 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.40 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.39 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.39 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.39 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.39 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.39 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
| ▸ | SRD5A1 | P18405 | 3/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.37 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.37 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.37 |
| ▸ | ITGAV | P06756 | 1/20 | 0.37 |
| ▸ | ITGA5 | P08648 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6194447 | 0.82 | TRPM5 (0.43) | MTNR1AESR1ESR2SRD5A1AHR | |
| SCHEMBL10841342 | 0.79 | AR (0.43) | MTNR1AESR1ESR2SRD5A1SRD5A2 | |
| SCHEMBL6196313 | 0.79 | ESR1 (0.39) | FFAR4MTNR1AESR1ESR2SRD5A1 | |
| SCHEMBL6196312 | 0.78 | GAA (0.45) | ESR1ESR2SRD5A1SRD5A2AHR | |
| SCHEMBL27528311 | 0.78 | ITGB3 (0.47) | ITGB3ITGA2BITGB2ITGB1ITGAV | |
| Hydrochloric Acid SCHEMBL11045497 | 0.77 | GAA (0.44) | ESR1ESR2SRD5A1SRD5A2AHR | |
| SCHEMBL18668619 | 0.76 | DRD2 (0.38) | GRIN2BFFAR4MTNR1ASRD5A1RIPK1 | |
| SCHEMBL17363948 | 0.73 | NR3C1 (0.42) | RIPK1CDC25B | |
| SCHEMBL17363934 | 0.73 | NR3C1 (0.42) | RIPK1CDC25B | |
| SCHEMBL17363890 | 0.73 | NR3C1 (0.42) | RIPK1CDC25B |
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 |
|---|---|---|---|---|---|---|---|
| EP-1963281-A2 | HETEROCYCLIC DERIVATIVES AS MODULATORS OF ION CHANNELS | Vertex Pharmaceuticals, Inc. (US) | 2008-09-03 | — | — | EP | disclosed |
| WO-2007075895-A2 | HETEROCYCLIC DERIVATIVES AS MODULATORS OF ION CHANNELS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2007-07-05 | — | — | WO | disclosed |