Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE10A | Q9Y233 | 7/20 | 0.69 |
| ▸ | PARP1 | P09874 | 3/20 | 0.68 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.68 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.64 |
| ▸ | RAB9A | P51151 | 2/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.56 |
| ▸ | RET | P07949 | 1/20 | 0.54 |
| ▸ | KDR | P35968 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL16404338 | 0.90 | PDE10A (0.84) | PDE10APARP1PARP2TNKS2KMT2A | |
| SCHEMBL3985227 | 0.86 | TNKS2 (0.70) | PDE10APARP1PARP2TNKS2KMT2A | |
| SCHEMBL31716684 | 0.86 | TNKS2 (0.70) | PDE10APARP1PARP2TNKS2KMT2A | |
| SCHEMBL30721110 | 0.83 | PARP1 (0.72) | PDE10APARP1PARP2TNKS2KMT2A | |
| SCHEMBL29431542 | 0.83 | PARP1 (0.82) | PDE10APARP1PARP2TNKS2KMT2A | |
| SCHEMBL5794718 | 0.83 | PARP1 (0.82) | PDE10APARP1PARP2TNKS2KMT2A | |
| SCHEMBL31397021 | 0.83 | PDE10A (0.69) | PDE10APARP1PARP2TNKS2KMT2A | |
| SCHEMBL11288070 | 0.83 | PDE10A (0.74) | PDE10APARP1PARP2TNKS2KMT2A | |
| SCHEMBL7526687 | 0.83 | PDE10A (0.69) | PDE10APARP1PARP2TNKS2KMT2A | |
| SCHEMBL29764103 | 0.83 | PDE10A (0.74) | PDE10APARP1PARP2TNKS2KMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103755647-B | C2 bit derivant of 4 (3H)-quinazolinones and its production and use | CAPITAL NORMAL UNIV. (CN) | 2015-12-09 | — | — | CN | disclosed |
| CN-103755647-A | C2-bit derivative of 4(3H)-quinazolinone and preparation method and application thereof | UNIV CAPITAL NORMAL | 2014-04-30 | — | — | CN | disclosed |
| EP-1646615-A1 | PYRIMIDINE DERIVATIVES AS MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | Vertex Pharmaceuticals Incorporated (US) | 2006-04-19 | — | — | EP | disclosed |
| WO-2004111014-A1 | PYRIMIDINE DERIVATIVES AS MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2004-12-23 | — | — | WO | disclosed |