Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR1B | P47901 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 7/20 | 0.37 |
| ▸ | GRIN1 | Q05586 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.35 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4302713 | 0.89 | AVPR1B (0.44) | AVPR1BLMNAGAANPC1GRIN2B | |
| SCHEMBL4309843 | 0.88 | AVPR1B (0.52) | AVPR1BGRIN2BGRIN1ALDH1A1KDM4E | |
| SCHEMBL4304952 | 0.82 | AVPR1B (0.63) | AVPR1B | |
| SCHEMBL8013549 | 0.77 | AVPR1B (0.56) | AVPR1BGRIN2B | |
| SCHEMBL4308725 | 0.72 | AVPR1B (0.75) | AVPR1B | |
| SCHEMBL4309710 | 0.70 | AVPR1B (0.50) | AVPR1B | |
| SCHEMBL4311095 | 0.70 | AVPR1B (0.68) | AVPR1B | |
| SCHEMBL4301376 | 0.70 | AVPR1B (0.66) | AVPR1BLMNAGRIN2BGRIN1NR1I2 | |
| SCHEMBL4315024 | 0.66 | AVPR1B (0.84) | AVPR1B | |
| SCHEMBL4306581 | 0.62 | AVPR1B (0.67) | AVPR1B |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2009130231-A1 | PYRROLO [1, 2-A] PYRAZINE DERIVATIVES AS VASOPRESSIN VIB RECEPTOR ANTAGONISTS | GLAXO GROUP LIMITED (GB) | 2009-10-29 | — | — | WO | disclosed |