Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.48 |
| ▸ | TACR1 | P25103 | 1/20 | 0.40 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.39 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | TNF | P01375 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | AMY1A | P0DUB6 | 1/20 | 0.34 |
| ▸ | HCRTR2 | O43614 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL22800908 | 0.83 | TAAR1 (0.55) | TAAR1TACR1NR3C1NR3C2TDP1 | |
| Bromide SCHEMBL11694687 | 0.82 | TAAR1 (0.42) | TAAR1TSHR | |
| SCHEMBL23211227 | 0.80 | TAAR1 (0.55) | TAAR1TACR1NR3C1NR3C2TDP1 | |
| SCHEMBL10922327 | 0.80 | HTR2A (0.47) | ALDH1A1 | |
| SCHEMBL4178223 | 0.79 | TAAR1 (0.46) | TAAR1TACR1NR3C1NR3C2TDP1 | |
| SCHEMBL4169345 | 0.79 | TAAR1 (0.46) | TAAR1TACR1NR3C1NR3C2TDP1 | |
| SCHEMBL4161045 | 0.79 | TAAR1 (0.46) | TAAR1TACR1NR3C1NR3C2TDP1 | |
| SCHEMBL6498287 | 0.79 | MC4R (0.38) | TAAR1 | |
| SCHEMBL6498282 | 0.79 | MC4R (0.38) | TAAR1 | |
| SCHEMBL24398825 | 0.78 | TAAR1 (0.50) | TAAR1TACR1NR3C1NR3C2TDP1 |
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-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-0142566-A1 | ASYMMETRICALLY MODIFIED BORON HYDRIDE COMPOUNDS, PROCESS FOR ITS PREPARATION, AND PROCESS FOR PREPARING OPTICALLY ACTIVE ALCOHOL DERIVATIVE USING SAME | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1985-05-29 | — | — | EP | disclosed |