Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | NOS3 | P29474 | 1/20 | 0.46 |
| ▸ | NOS1 | P29475 | 1/20 | 0.46 |
| ▸ | NOS2 | P35228 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.45 |
| ▸ | HTR6 | P50406 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | TDO2 | P48775 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | PRKCQ | Q04759 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14417239 | 0.82 | ALDH1A1 (0.44) | ALDH1A1MAPTPOLBKMT2AMEN1 | |
| SCHEMBL14498138 | 0.81 | ALDH1A1 (0.66) | ALDH1A1MAPTKMT2AMEN1KDM4E | |
| SCHEMBL14410262 | 0.80 | NOS3 (0.49) | ALDH1A1MAPTPOLBKMT2AMEN1 | |
| SCHEMBL19117357 | 0.79 | BCHE (0.42) | POLBNOS3NOS1NOS2CHRM1 | |
| SCHEMBL16463561 | 0.77 | KDM1A (0.56) | ALDH1A1POLBKMT2AMEN1KDM4E | |
| SCHEMBL5992982 | 0.76 | BCHE (0.58) | ALDH1A1MAPTPOLBKMT2AMEN1 | |
| Bromide SCHEMBL11097137 | 0.76 | MAPT (0.58) | ALDH1A1MAPTPOLBKMT2AMEN1 | |
| SCHEMBL16465006 | 0.75 | ALDH1A1 (0.41) | ALDH1A1MAPTPOLBKMT2AMEN1 | |
| SCHEMBL16463498 | 0.74 | POLB (0.45) | ALDH1A1MAPTPOLBKMT2AMEN1 | |
| SCHEMBL16463510 | 0.74 | ALDH1A1 (0.40) | ALDH1A1MAPTPOLBKMT2AMEN1 |
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-7230001-B1 | Arylalkane, arylalkene and aryl azaalkane, medicaments containing said compounds and method for the production thereof | BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) | 2007-06-12 | — | — | US | disclosed |