Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AVPR1A | P37288 | 4/20 | 0.38 |
| ▸ | BRD4 | O60885 | 11/20 | 0.37 |
| ▸ | OXTR | P30559 | 4/20 | 0.35 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | BRD2 | P25440 | 1/20 | 0.31 |
| ▸ | BRD3 | Q15059 | 1/20 | 0.31 |
| ▸ | BRDT | Q58F21 | 1/20 | 0.31 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8257678 | 0.83 | AVPR1A (0.41) | AVPR1AOXTR | |
| SCHEMBL8258677 | 0.80 | AVPR1A (0.31) | AVPR1A | |
| SCHEMBL8252339 | 0.76 | AVPR1A (0.36) | AVPR1ABRD4OXTR | |
| SCHEMBL29163640 | 0.71 | NOTUM (0.39) | AVPR1AKMT2AKDM4E | |
| SCHEMBL4620922 | 0.71 | BRD4 (0.46) | AVPR1ABRD4OXTRTRPA1TRPM8 | |
| SCHEMBL8256810 | 0.69 | AVPR1A (0.48) | AVPR1ABRD4OXTRTRPA1TRPM8 | |
| SCHEMBL5155966 | 0.69 | AVPR1A (0.48) | AVPR1ABRD4OXTRTRPA1TRPM8 | |
| SCHEMBL8285404 | 0.68 | ADRB1 (0.56) | AVPR1ABRD4TRPA1TRPM8 | |
| Hydrochloric Acid SCHEMBL315285 | 0.68 | AVPR1A (0.47) | AVPR1ABRD4OXTRTRPA1TRPM8 | |
| Hydrochloric Acid SCHEMBL5156223 | 0.68 | AVPR1A (0.47) | AVPR1ABRD4OXTRTRPA1TRPM8 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006123242-A1 | 1, 2, 4 -TRIAZOLE DERIVATIVES AS VASOPRESSIN ANTAGONISTS | PFIZER LIMITED (GB) | 2006-11-23 | — | — | WO | disclosed |