Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR2 | P30518 | 4/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.47 |
| ▸ | AVPR1A | P37288 | 2/20 | 0.46 |
| ▸ | IDO1 | P14902 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.46 |
| ▸ | F10 | P00742 | 3/20 | 0.46 |
| ▸ | OXTR | P30559 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | SLC12A2 | P55011 | 1/20 | 0.43 |
| ▸ | WNK1 | Q9H4A3 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8827696 | 0.95 | AVPR2 (0.49) | AVPR2HDAC1HDAC6AVPR1AIDO1 | |
| SCHEMBL8827668 | 0.93 | AVPR2 (0.49) | AVPR2HDAC1HDAC6AVPR1AIDO1 | |
| SCHEMBL8827612 | 0.91 | AVPR2 (0.54) | AVPR2HDAC1HDAC6AVPR1AIDO1 | |
| SCHEMBL8827569 | 0.90 | AVPR2 (0.49) | AVPR2HDAC1HDAC6AVPR1AIDO1 | |
| Hydrochloric Acid SCHEMBL8827701 | 0.90 | F10 (0.51) | AVPR2HDAC1HDAC6AVPR1AIDO1 | |
| SCHEMBL8827580 | 0.89 | AVPR2 (0.46) | AVPR2HDAC1HDAC6AVPR1AIDO1 | |
| SCHEMBL8827570 | 0.88 | AVPR2 (0.49) | AVPR2HDAC1HDAC6AVPR1AIDO1 | |
| SCHEMBL8827579 | 0.88 | AVPR2 (0.52) | AVPR2HDAC1HDAC6AVPR1AIDO1 | |
| SCHEMBL7354914 | 0.76 | AVPR2 (0.53) | AVPR2AVPR1A | |
| Hydrochloric Acid SCHEMBL7351822 | 0.76 | AVPR2 (0.52) | AVPR2AVPR1AIDO1KCNH2OXTR |
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 |
|---|---|---|---|---|---|---|---|
| US-5677299-A | VASOPRESSIN OR OXYTOCIN ANTAGONIST | OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) | 1997-10-14 | — | — | US | disclosed |
| US-5498609-A | Benzoazepinyl compounds as oxytocin and vasopressin antagonists | OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) | 1996-03-12 | — | — | US | disclosed |
| EP-0612319-A1 | BENZOHETEROCYCLIC COMPOUNDS AS OXYTOCIN AND VASOPRESSIN ANTAGONISTS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1994-08-31 | — | — | EP | disclosed |
| WO-1994004525-A1 | BENZOHETEROCYCLIC COMPOUNDS AS OXYTOCIN AND VASOPRESSIN ANTAGONISTS | OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) | 1994-03-03 | — | — | WO | disclosed |