Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.38 |
| ▸ | CCR2 | P41597 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 3/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10927411 | 1.00 | CYP2C9 (0.40) | CYP2C9MAPTALDH1A1LMNAPKM | |
| SCHEMBL10929530 | 0.96 | CYP2C9 (0.41) | CYP2C9MAPTALDH1A1LMNAPKM | |
| SCHEMBL10929510 | 0.96 | CYP2C9 (0.41) | CYP2C9MAPTALDH1A1LMNAPKM | |
| SCHEMBL10926849 | 0.91 | CYP2C9 (0.39) | CYP2C9MAPTALDH1A1LMNAPKM | |
| SCHEMBL10929806 | 0.91 | CYP2C9 (0.39) | CYP2C9MAPTALDH1A1LMNAPKM | |
| SCHEMBL10927798 | 0.91 | CYP2C9 (0.49) | CYP2C9MAPTALDH1A1LMNAKMT2A | |
| SCHEMBL10927809 | 0.91 | CYP2C9 (0.49) | CYP2C9MAPTALDH1A1LMNAKMT2A | |
| SCHEMBL8635813 | 0.88 | CYP2C9 (0.41) | CYP2C9MAPTALDH1A1LMNAPKM | |
| SCHEMBL5244532 | 0.88 | CYP2C9 (0.41) | CYP2C9MAPTALDH1A1LMNAPKM | |
| SCHEMBL10891960 | 0.88 | MAPT (0.41) | CYP2C9MAPTALDH1A1LMNAPKM |
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-4551264-A | Polyhalogenoaromatic compounds for liquid crystal compositions | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1985-11-05 | — | — | US | disclosed |