Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR2 | P30518 | 2/20 | 0.53 |
| ▸ | AVPR1A | P37288 | 2/20 | 0.53 |
| ▸ | BCHE | P06276 | 9/20 | 0.47 |
| ▸ | ACHE | P22303 | 3/20 | 0.47 |
| ▸ | HSD17B3 | P37058 | 2/20 | 0.44 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8559586 | 0.84 | AVPR2 (0.46) | AVPR2AVPR1AHSD17B3P2RX4HPGD | |
| SCHEMBL8559583 | 0.82 | BCHE (0.67) | AVPR2AVPR1ABCHEACHEP2RX4 | |
| SCHEMBL8557423 | 0.80 | ACHE (0.51) | AVPR2AVPR1AACHEHSD17B3RAB9A | |
| SCHEMBL8558207 | 0.79 | AVPR2 (0.60) | AVPR2AVPR1AHSD17B3P2RX4HPGD | |
| SCHEMBL7341183 | 0.79 | AVPR2 (0.57) | AVPR2AVPR1AHSD17B3P2RX4HPGD | |
| SCHEMBL31332440 | 0.78 | HSD17B3 (0.68) | BCHEHSD17B3 | |
| SCHEMBL8555635 | 0.78 | HSD11B1 (0.47) | BCHEACHEALDH1A1NPC1RAB9A | |
| SCHEMBL8559312 | 0.76 | AVPR1A (0.55) | AVPR2AVPR1A | |
| SCHEMBL8558825 | 0.76 | AVPR1A (0.53) | AVPR2AVPR1AKMT2A | |
| SCHEMBL8556946 | 0.76 | 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 3 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 |
| WO-1997047624-A1 | TRICYCLIC BENZAZEPINE VASOPRESSIN ANTAGONISTS | AMERICAN CYANAMID COMPANY (US) | 1997-12-18 | — | — | WO | disclosed |
| EP-0640592-A1 | N-acylated tricyclic azaheterorings useful as vasopressin antagonists | AMERICAN CYANAMID COMPANY (US) | 1995-03-01 | — | — | EP | disclosed |