Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | ATM | Q13315 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | PLEC | Q15149 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 6/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.44 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.44 |
| ▸ | CACNA1D | Q01668 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL5696510 | 0.87 | SLC6A2 (0.46) | ALDH1A1L3MBTL1MAPTNPSR1ATM | |
| SCHEMBL5696521 | 0.83 | IDO1 (0.50) | ALDH1A1L3MBTL1MAPTATMMEN1 | |
| Hydrochloric Acid SCHEMBL10411195 | 0.81 | IDO1 (0.51) | ALDH1A1MAPTGAAKMT2AKCNH2 | |
| SCHEMBL27486127 | 0.81 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1MAPTNPSR1ATM | |
| SCHEMBL14478203 | 0.81 | L3MBTL1 (0.53) | ALDH1A1L3MBTL1MAPTNPSR1ATM | |
| SCHEMBL5696492 | 0.80 | HTR2A (0.42) | MEN1KMT2ATDP1CYP2D6 | |
| SCHEMBL27332772 | 0.80 | ALDH1A1 (0.45) | ALDH1A1L3MBTL1MAPTMEN1GAA | |
| SCHEMBL10866595 | 0.80 | MAPT (0.48) | ALDH1A1L3MBTL1MAPTNPSR1ATM | |
| Hydrochloric Acid SCHEMBL10922381 | 0.78 | HTR2A (0.41) | MAPTKMT2ACYP2D6 | |
| SCHEMBL13957565 | 0.78 | NOS3 (0.52) | ALDH1A1L3MBTL1MAPTNPSR1ATM |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1673375-A2 | METHOD FOR THE IN SITU PREPARATION OF CHIRAL COMPOUNDS DERIVED FROM OXAZABOROLIDINE-BORANE COMPLEXES, WHICH ARE USED IN ASYMMETRIC REDUCTION REACTIONS | PPG-Sipsy (FR) | 2006-06-28 | — | — | EP | disclosed |
| WO-2005035540-A2 | METHOD FOR THE IN SITU PREPARATION OF CHIRAL COMPOUNDS DERIVED FROM OXAZABOROLIDINE-BORANE COMPLEXES, WHICH ARE USED IN ASYMMETRIC REDUCTION REACTIONS | PPG-SIPSY (FR) | 2005-04-21 | — | — | WO | disclosed |
| EP-0171175-A1 | An optically active borane complex and a method for producing an optically active alcohol derivative by the use thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1986-02-12 | — | — | EP | disclosed |
| EP-0170350-A1 | An asymmetrically modified boron hydride type compound, a production method thereof, and a method for producing an optically active alcohol derivative by the use thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1986-02-05 | — | — | EP | disclosed |