Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.38 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PTGS2 | P35354 | 5/20 | 0.34 |
| ▸ | FAAH | O00519 | 2/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.32 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.32 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | ACACB | O00763 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.31 |
| ▸ | CDC42 | P60953 | 1/20 | 0.31 |
| ▸ | RAC1 | P63000 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | SLC22A6 | Q4U2R8 | 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 | |
|---|---|---|---|---|
| SCHEMBL91900 | 0.78 | MMP3 (0.36) | L3MBTL1FFAR1CYP1A2 | |
| SCHEMBL13186058 | 0.71 | L3MBTL1 (0.44) | TDP1L3MBTL1CYP1A2 | |
| SCHEMBL13863880 | 0.71 | FFAR1 (0.36) | L3MBTL1FFAR1CYP1A2 | |
| SCHEMBL13863856 | 0.71 | FFAR1 (0.34) | L3MBTL1FFAR1CYP1A2 | |
| SCHEMBL13863882 | 0.71 | TDP1 (0.57) | AKR1C3AKR1C2TDP1L3MBTL1PTGS2 | |
| SCHEMBL13186042 | 0.69 | LMNA (0.44) | L3MBTL1PTGS2CYP1A2TSHR | |
| SCHEMBL91833 | 0.68 | RXFP1 (0.33) | FFAR1 | |
| SCHEMBL14640143 | 0.68 | LMNA (0.43) | L3MBTL1PTGS2ACACBCYP1A2 | |
| SCHEMBL13186040 | 0.68 | LMNA (0.43) | L3MBTL1PTGS2ACACBCYP1A2 | |
| SCHEMBL13186055 | 0.67 | FAAH (0.46) | L3MBTL1FAAHFFAR1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-8129002-B2 | Compounds for use in liquid crystal media | MERCK PATENT GMBH (DE) | 2012-03-06 | — | — | US | disclosed |