Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.53 |
| ▸ | AVPR2 | P30518 | 7/20 | 0.50 |
| ▸ | AVPR1A | P37288 | 7/20 | 0.50 |
| ▸ | OXTR | P30559 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.46 |
| ▸ | NAMPT | P43490 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.45 |
| ▸ | CA7 | P43166 | 1/20 | 0.45 |
| ▸ | CA9 | Q16790 | 1/20 | 0.45 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8558207 | 0.87 | AVPR2 (0.60) | HPGDALDH1A1AVPR2AVPR1AOXTR | |
| SCHEMBL8558342 | 0.87 | HPGD (0.48) | HPGDALDH1A1AVPR2AVPR1AOXTR | |
| SCHEMBL8555952 | 0.83 | NAMPT (0.51) | HPGDALDH1A1AVPR2AVPR1ARAB9A | |
| SCHEMBL8560873 | 0.83 | ACHE (0.60) | AVPR2AVPR1ARAB9AHSD17B3NAMPT | |
| SCHEMBL7342110 | 0.78 | HPGD (0.63) | HPGDALDH1A1AVPR2AVPR1AOXTR | |
| SCHEMBL8556540 | 0.77 | HSD17B3 (0.45) | HPGDAVPR2AVPR1ARAB9ASMN1; SMN2 | |
| SCHEMBL8557861 | 0.77 | AVPR1A (0.45) | HPGDALDH1A1AVPR2AVPR1AOXTR | |
| SCHEMBL8562633 | 0.77 | AVPR2 (0.55) | HPGDAVPR2AVPR1AOXTRRAB9A | |
| SCHEMBL8557607 | 0.77 | NPC1 (0.50) | ALDH1A1AVPR2AVPR1ARAB9ANPC1 | |
| SCHEMBL7348349 | 0.77 | AVPR2 (0.76) | HPGDALDH1A1AVPR2AVPR1AOXTR |
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-0640592-B1 | N-acylated tricyclic azaheterorings useful as vasopressin antagonists | AMERICAN CYANAMID CO (US) | 1998-12-30 | — | — | EP | disclosed |
| EP-0640592-A1 | N-acylated tricyclic azaheterorings useful as vasopressin antagonists | AMERICAN CYANAMID COMPANY (US) | 1995-03-01 | — | — | EP | disclosed |