Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FFAR1 | O14842 | 6/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.35 |
| ▸ | ACACB | O00763 | 3/20 | 0.33 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.33 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.32 |
| ▸ | RARA | P10276 | 1/20 | 0.32 |
| ▸ | RARB | P10826 | 1/20 | 0.32 |
| ▸ | RARG | P13631 | 1/20 | 0.32 |
| ▸ | GRM5 | P41594 | 2/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | FAAH | O00519 | 1/20 | 0.30 |
| ▸ | GCGR | P47871 | 1/20 | 0.30 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | RAB9A | P51151 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8774297 | 0.96 | FFAR1 (0.40) | FFAR1CYP2A6ACACBEGLN1FFAR4 | |
| SCHEMBL8774994 | 0.89 | FFAR1 (0.42) | FFAR1ACACBFFAR4RARARARB | |
| SCHEMBL8774912 | 0.87 | TSHR (0.43) | FFAR1RARARARBRARGSMN1; SMN2 | |
| SCHEMBL8774909 | 0.85 | HSD17B10 (0.48) | FFAR1RARARARBRARGSMN1; SMN2 | |
| SCHEMBL8774295 | 0.84 | FFAR1 (0.44) | FFAR1ACACBFFAR4 | |
| SCHEMBL8775031 | 0.83 | CYP11B1 (0.39) | FFAR1ACACBFFAR4SMN1; SMN2NPC1 | |
| SCHEMBL8774403 | 0.83 | FFAR1 (0.38) | FFAR1CYP2A6ACACBEGLN1FFAR4 | |
| SCHEMBL8774821 | 0.82 | FFAR1 (0.43) | FFAR1FFAR4RARARARBRARG | |
| SCHEMBL8774463 | 0.81 | MCHR1 (0.41) | ACACBSMN1; SMN2NPC1GAARAB9A | |
| SCHEMBL8775170 | 0.81 | CYP2D6 (0.46) | RARARARBSMN1; SMN2NPC1POLB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0519370-B1 | Heterocyclic derivatives | MERCK PATENT GMBH (DE) | 1997-11-05 | — | — | EP | disclosed |
| EP-0519370-A2 | Heterocyclic derivatives | MERCK PATENT GmbH (DE) | 1992-12-23 | — | — | EP | disclosed |