Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR2 | P30518 | 3/20 | 0.55 |
| ▸ | AVPR1A | P37288 | 3/20 | 0.55 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | ACHE | P22303 | 2/20 | 0.45 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8561645 | 0.92 | AVPR2 (0.58) | AVPR2AVPR1AACHENPSR1 | |
| SCHEMBL8557607 | 0.89 | NPC1 (0.50) | AVPR2AVPR1AALDH1A1NPSR1 | |
| SCHEMBL8561097 | 0.87 | AVPR2 (0.52) | AVPR2AVPR1AMEN1KMT2AHDAC1 | |
| SCHEMBL8563565 | 0.87 | NAMPT (0.50) | AVPR2AVPR1AMEN1KMT2AHDAC1 | |
| SCHEMBL8557503 | 0.84 | ACHE (0.58) | AVPR2AVPR1AACHEHSD17B3 | |
| SCHEMBL8558027 | 0.83 | AVPR2 (0.69) | AVPR2AVPR1A | |
| SCHEMBL8563019 | 0.82 | AVPR2 (0.59) | AVPR2AVPR1AACHE | |
| SCHEMBL8563344 | 0.81 | AVPR2 (0.81) | AVPR2AVPR1A | |
| SCHEMBL8559349 | 0.81 | AVPR2 (0.60) | AVPR2AVPR1AACHE | |
| SCHEMBL8562633 | 0.80 | AVPR2 (0.55) | AVPR2AVPR1A |
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 |