Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 3/20 | 0.47 |
| ▸ | HTR2B | P41595 | 3/20 | 0.47 |
| ▸ | QPCT | Q16769 | 5/20 | 0.39 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 2/20 | 0.33 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.33 |
| ▸ | PIM1 | P11309 | 1/20 | 0.33 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL434618 | 0.84 | PDE4A (0.46) | HTR2CKMT2AHRH3L3MBTL1 | |
| SCHEMBL29543900 | 0.84 | PDE4A (0.46) | HTR2CKMT2AHRH3L3MBTL1 | |
| SCHEMBL4237792 | 0.84 | MAPT (0.41) | QPCTHRH3MAPTMAPK1L3MBTL1 | |
| SCHEMBL6946821 | 0.81 | PARP1 (0.38) | HTR2CHTR2BQPCTPARP1MAPT | |
| SCHEMBL29601297 | 0.79 | CYP3A4 (0.44) | KMT2APARP1MAPT | |
| SCHEMBL30987232 | 0.75 | MPO (0.41) | KMT2AMAPTMAPK1 | |
| SCHEMBL5062914 | 0.75 | KDM4E (0.32) | — | |
| Hydrochloric Acid SCHEMBL21174542 | 0.74 | KDM4E (0.32) | — | |
| SCHEMBL11066168 | 0.72 | PDK2 (0.35) | HRH3 | |
| SCHEMBL31321953 | 0.72 | — | — |
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-1349857-A1 | PURINE DERIVATIVES AS PURINERGIC RECEPTOR ANTAGONISTS | VERNALIS RESEARCH LIMITED (GB) | 2003-10-08 | — | — | EP | disclosed |
| WO-2002055521-A1 | PURINE DERIVATIVES AS PURINERGIC RECEPTOR ANTAGONISTS | VERNALIS RESEARCH LIMITED (GB) | 2002-07-18 | — | — | WO | disclosed |