Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KLKB1 | P03952 | 3/20 | 0.32 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | JAK2 | O60674 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.31 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL2221341 | 0.93 | PDE10A (0.33) | PDE10ARAB9AKMT2AMEN1KLKB1 | |
| SCHEMBL2221519 | 0.93 | TP53 (0.35) | PDE10ARAB9AKMT2AMEN1CACNA2D1 | |
| SCHEMBL2362863 | 0.92 | PDE10A (0.35) | PDE10ARAB9AKMT2AMEN1CACNA2D1 | |
| SCHEMBL2223717 | 0.92 | KMT2A (0.33) | PDE10ARAB9AKMT2AMEN1KLKB1 | |
| SCHEMBL13275164 | 0.91 | CACNA2D1 (0.39) | PDE10ARAB9AKMT2AMEN1CACNA2D1 | |
| SCHEMBL2223072 | 0.91 | PDE10A (0.37) | PDE10ARAB9AKMT2AMEN1CACNA2D1 | |
| SCHEMBL13274853 | 0.90 | PDE10A (0.33) | PDE10ARAB9AKMT2AMEN1CACNA2D1 | |
| SCHEMBL13506697 | 0.89 | PDE10A (0.33) | PDE10ARAB9AKMT2AMEN1CACNA2D1 | |
| SCHEMBL2221099 | 0.88 | TP53 (0.38) | RAB9AKMT2AMEN1CACNA2D1TP53 | |
| SCHEMBL13275008 | 0.87 | OPRM1 (0.36) | CACNA2D1CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011084402-A1 | TYROSINE KINASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2011-07-14 | — | — | WO | claimed |
| WO-2011084402-A1 | TYROSINE KINASE INHIBITORS | MERCK SHARP & DOHME CORP. (US) | 2011-07-14 | — | — | WO | disclosed |