Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 2/20 | 0.44 |
| ▸ | FFAR1 | O14842 | 5/20 | 0.42 |
| ▸ | ACACB | O00763 | 6/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.36 |
| ▸ | SNCA | P37840 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9159008 | 0.95 | GRM5 (0.48) | GRM5FFAR1ACACB | |
| SCHEMBL9766618 | 0.94 | HSD17B10 (0.44) | GRM5FFAR1ACACBHSD17B10NPC1 | |
| SCHEMBL9158502 | 0.91 | HSD17B10 (0.47) | GRM5FFAR1ACACBHSD17B10NPC1 | |
| SCHEMBL9156046 | 0.90 | HSD17B10 (0.52) | GRM5FFAR1HSD17B10NPC1RAB9A | |
| SCHEMBL9154247 | 0.88 | GRM5 (0.47) | GRM5FFAR1ACACBSNCA | |
| SCHEMBL9158558 | 0.86 | GRM5 (0.46) | GRM5FFAR1ACACBHSD17B10PKM | |
| SCHEMBL9162555 | 0.85 | HSD17B10 (0.45) | GRM5FFAR1ACACBHSD17B10TP53 | |
| SCHEMBL9156341 | 0.84 | CYP2A6 (0.44) | HSD17B10NPC1TP53PKMRAB9A | |
| SCHEMBL9158742 | 0.84 | CYP2A6 (0.44) | HSD17B10NPC1TP53PKMRAB9A | |
| SCHEMBL9158759 | 0.84 | HSD17B10 (0.48) | GRM5FFAR1HSD17B10NPC1TP53 |
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-0445248-B1 | PYRIDINE DERIVATIVES | MERCK PATENT GMBH (DE) | 1995-03-08 | — | — | EP | disclosed |
| US-5205962-A | Stable liquid crystals | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1993-04-27 | — | — | US | disclosed |
| WO-1991004248-A1 | PYRIDINE DERIVATIVES | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1991-04-04 | — | — | WO | disclosed |