Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FASN | P49327 | 5/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | HNF4A | P41235 | 1/20 | 0.35 |
| ▸ | PTGES | O14684 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | TYK2 | P29597 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4565286 | 0.83 | FASN (0.37) | FASNPTGESKDM4EALDH1A1HSD17B10 | |
| SCHEMBL13907875 | 0.82 | ALDH1A1 (0.39) | FASNTSHRHTTKDM4EALDH1A1 | |
| SCHEMBL13906625 | 0.81 | NPC1 (0.37) | L3MBTL1ALDH1A1 | |
| SCHEMBL15554717 | 0.75 | FASN (0.54) | FASNL3MBTL1HNF4ATSHRHTT | |
| SCHEMBL13907803 | 0.72 | TDP1 (0.53) | TSHRKDM4EALDH1A1HSD17B10HPGD | |
| SCHEMBL13907999 | 0.70 | KMT2A (0.39) | FASNALDH1A1HSD17B10 | |
| SCHEMBL15554667 | 0.69 | FASN (0.47) | FASNPTGES | |
| SCHEMBL13906484 | 0.68 | NPY5R (0.43) | L3MBTL1TSHRHTTKDM4EALDH1A1 | |
| SCHEMBL8847760 | 0.67 | ADORA1 (0.46) | TSHRHTTKDM4EALDH1A1HPGD | |
| SCHEMBL31401543 | 0.67 | TSHR (0.52) | HNF4ATSHRHTTALDH1A1HPGD |
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-2009034029-A2 | 1-SUBSTITUTED 4-HETEROCYCLYLPIPERIDINES FOR USE AS CGRP ANTAGONISTS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-03-19 | — | — | WO | disclosed |