Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NCEH1 | Q6PIU2 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | HPGD | P15428 | 2/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | DHODH | Q02127 | 2/20 | 0.37 |
| ▸ | F10 | P00742 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29636491 | 0.81 | ALDH1A1 (0.57) | ALDH1A1HPGDHSD17B10CYP2C9CYP2C19 | |
| SCHEMBL6703588 | 0.80 | ALDH1A1 (0.60) | ALDH1A1HPGDHSD17B10CYP2C9CYP2C19 | |
| SCHEMBL11053906 | 0.79 | NCEH1 (0.43) | NCEH1ALDH1A1HPGDHSD17B10CYP2C19 | |
| SCHEMBL11049872 | 0.76 | NCEH1 (0.43) | NCEH1ALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL15644255 | 0.75 | ALDH1A1 (0.48) | NCEH1ALDH1A1BACE1MAPTMEN1 | |
| SCHEMBL4072743 | 0.71 | NCEH1 (0.66) | NCEH1ALDH1A1CYP2C9CYP2C19MAPT | |
| SCHEMBL264367 | 0.71 | CYP2A6 (0.55) | NCEH1ALDH1A1HPGDMAPTMEN1 | |
| SCHEMBL30350490 | 0.71 | CYP2A6 (0.55) | NCEH1ALDH1A1HPGDMAPTMEN1 | |
| SCHEMBL2643193 | 0.71 | CYP2A6 (0.46) | NCEH1ALDH1A1BACE1MAPTMEN1 | |
| SCHEMBL29353067 | 0.69 | CYP2A6 (0.77) | NCEH1ALDH1A1CYP2C19BACE1MAPT |
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-0409413-B1 | Diaryl ether heterocycles | ICI PLC (GB) | 1994-08-03 | — | — | EP | disclosed |
| US-5208259-A | Lipoxygenase enzyme inhibitors | IMPERIAL CHEMICAL INDUSTRIES (GB) | 1993-05-04 | — | — | US | disclosed |
| EP-0409413-A2 | Diaryl ether heterocycles | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-01-23 | — | — | EP | disclosed |