Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XIAP | P98170 | 1/20 | 0.45 |
| ▸ | BIRC2 | Q13490 | 1/20 | 0.45 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.42 |
| ▸ | LTA4H | P09960 | 3/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.39 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.37 |
| ▸ | IDH1 | O75874 | 1/20 | 0.37 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.36 |
| ▸ | TACR1 | P25103 | 1/20 | 0.36 |
| ▸ | TACR3 | P29371 | 1/20 | 0.36 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.36 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL19675614 | 0.81 | HTR2C (0.37) | HRH3SLC22A12ALDH1A1 | |
| SCHEMBL23633844 | 0.80 | HTR2C (0.36) | HRH3SLC6A2SLC6A4SLC22A12 | |
| SCHEMBL23633850 | 0.80 | HTR2C (0.39) | HRH3SLC22A12 | |
| SCHEMBL23633824 | 0.80 | HTR2A (0.39) | HRH3SLC6A2SLC6A4SLC22A12 | |
| SCHEMBL20381958 | 0.79 | HTR2C (0.47) | HRH3SLC22A12 | |
| SCHEMBL12060709 | 0.78 | XIAP (0.46) | XIAPBIRC2HRH3LTA4HPARP11 | |
| SCHEMBL22005066 | 0.77 | HSD17B3 (0.43) | HRH3 | |
| SCHEMBL12049118 | 0.77 | XIAP (0.45) | XIAPBIRC2HRH3LTA4HPARP11 | |
| SCHEMBL23633849 | 0.75 | NOTUM (0.36) | HRH3SLC22A12ALDH1A1 | |
| SCHEMBL19115422 | 0.75 | HTR2C (0.37) | HRH3SLC22A12 |
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-2007061695-A2 | BICYCLIC SPIROHYDANTOIN CGRP RECEPTOR ANTAGONISTS | MERCK & CO., INC. (US) | 2007-05-31 | — | — | WO | disclosed |