Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR1A | P37288 | 4/20 | 0.40 |
| ▸ | AVPR2 | P30518 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.36 |
| ▸ | AVPR1B | P47901 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8560108 | 0.87 | AVPR2 (0.38) | AVPR1AAVPR2ALDH1A1NPSR1HSD17B3 | |
| SCHEMBL8559426 | 0.85 | KMT2A (0.46) | AVPR1AAVPR2ALDH1A1NPSR1MEN1 | |
| SCHEMBL8558783 | 0.84 | PKM (0.50) | AVPR1AAVPR2AVPR1BMEN1NPC1 | |
| SCHEMBL8557088 | 0.80 | AVPR1A (0.48) | AVPR1AAVPR2AVPR1B | |
| SCHEMBL8559128 | 0.80 | AVPR1A (0.37) | AVPR1AAVPR2ALDH1A1NPSR1HSD17B3 | |
| SCHEMBL8564493 | 0.79 | KCNJ5 (0.46) | MAPTNPC1RAB9A | |
| SCHEMBL8563203 | 0.79 | MEN1 (0.47) | ALDH1A1NPSR1MAPTMEN1KMT2A | |
| SCHEMBL8559901 | 0.78 | AVPR2 (0.63) | AVPR1AAVPR2 | |
| SCHEMBL8562420 | 0.76 | AVPR2 (0.46) | AVPR1AAVPR2ALDH1A1MEN1NPC1 | |
| SCHEMBL8558298 | 0.76 | AVPR2 (0.55) | AVPR1AAVPR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0640592-B1 | N-acylated tricyclic azaheterorings useful as vasopressin antagonists | AMERICAN CYANAMID CO (US) | 1998-12-30 | — | — | EP | disclosed |