Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | PDCD1 | Q15116 | 3/20 | 0.44 |
| ▸ | CD274 | Q9NZQ7 | 3/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | CDK4 | P11802 | 1/20 | 0.42 |
| ▸ | CCND1 | P24385 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.41 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5885855 | 0.82 | TSHR (0.51) | MAPK1TSHRHSD17B10PDCD1CD274 | |
| SCHEMBL25423383 | 0.79 | MAOB (0.48) | PDCD1CD274CYP1A1CYP1A2CYP2B6 | |
| SCHEMBL10982314 | 0.78 | PDCD1 (0.60) | MAPK1HSD17B10PDCD1CD274ALDH1A1 | |
| SCHEMBL30625954 | 0.78 | PDCD1 (0.60) | MAPK1HSD17B10PDCD1CD274ALDH1A1 | |
| SCHEMBL17295958 | 0.77 | ABCB1 (0.52) | MAPK1TSHRHSD17B10PDCD1CD274 | |
| SCHEMBL28854331 | 0.76 | HTR7 (0.51) | MAPK1TSHRLMNAALDH1A1HTR7 | |
| SCHEMBL28679880 | 0.76 | CYP1A1 (0.45) | LMNAALDH1A1HTR7BRD4HDAC4 | |
| SCHEMBL3455245 | 0.75 | ABL1 (0.60) | MAPK1LMNAALDH1A1BRD4ADORA2A | |
| SCHEMBL2020140 | 0.74 | ABL1 (0.59) | LMNAALDH1A1BRD4HDAC4HDAC8 | |
| SCHEMBL30728873 | 0.74 | HTR7 (0.43) | MAPK1TSHRCD274LMNAALDH1A1 |
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-2010023317-A1 | NOVEL HEXAFLUORO-2-BIPHENYLISOPROPANOL COMPOUNDS THAT MODULATE LXR-TYPE RECEPTORS, PROCESS FOR THE PREPARATION THEREOF AND USE THEREOF AS MEDICAMENTS IN HUMAN AND VETERINARY MEDICINE AND ALSO IN COSMETICS | GALDERMA RESEARCH & DEVELOPMENT (FR) | 2010-03-04 | — | — | WO | disclosed |