Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | CD44 | P16070 | 1/20 | 0.42 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.35 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.35 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.35 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.35 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | DAO | P14920 | 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 | |
|---|---|---|---|---|
| SCHEMBL10493709 | 0.90 | CYP3A4 (0.44) | CYP3A4TSHRMAPK1TDP1CD44 | |
| SCHEMBL11548109 | 0.81 | TSHR (0.55) | CYP3A4TSHRMAPK1TDP1LMNA | |
| SCHEMBL10279383 | 0.80 | CD44 (0.42) | CYP3A4TSHRMAPK1TDP1CD44 | |
| SCHEMBL6353876 | 0.78 | TSHR (0.52) | CYP3A4TSHRMAPK1TDP1LMNA | |
| SCHEMBL9244738 | 0.78 | RAPGEF4 (0.43) | CYP3A4CD44GRIN2DGRIN3BGRIN1 | |
| SCHEMBL11226916 | 0.78 | TSHR (0.57) | CYP3A4TSHRMAPK1TDP1LMNA | |
| SCHEMBL8261003 | 0.74 | CD44 (0.58) | CYP3A4TSHRMAPK1CD44GRIN2D | |
| SCHEMBL11685824 | 0.73 | TSHR (0.52) | CYP3A4TSHRMAPK1TDP1LMNA | |
| SCHEMBL8916390 | 0.72 | TSHR (0.41) | CYP3A4TSHRMAPK1TDP1CD44 | |
| SCHEMBL30855347 | 0.72 | TSHR (0.41) | CYP3A4TSHRMAPK1TDP1CD44 |
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-4876404-A | Preparation of dichlorotrifluoromethyltoluenes including novel isomers | CENTRAL GLASS COMPANY, LIMITED (JP) | 1989-10-24 | — | — | US | disclosed |