Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | TTR | P02766 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | KCNA5 | P22460 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.40 |
| ▸ | CRHBP | P24387 | 1/20 | 0.39 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.38 |
| ▸ | MAN2A1 | Q16706 | 1/20 | 0.37 |
| ▸ | MAN1B1 | Q9UKM7 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5696425 | 1.00 | ALDH1A1 (0.52) | ALDH1A1CYP2D6CYP2C19HSD17B10MEN1 | |
| SCHEMBL301345 | 0.82 | ALDH1A1 (0.57) | ALDH1A1CYP2D6CYP2C19HSD17B10MEN1 | |
| SCHEMBL6021075 | 0.82 | ALDH1A1 (0.57) | ALDH1A1CYP2D6CYP2C19HSD17B10MEN1 | |
| SCHEMBL17231876 | 0.81 | ALDH1A1 (0.52) | ALDH1A1CYP2D6CYP2C19HSD17B10MEN1 | |
| SCHEMBL6470482 | 0.80 | CYP2C19 (0.55) | ALDH1A1CYP2D6CYP2C19HSD17B10MEN1 | |
| SCHEMBL7491387 | 0.76 | CYP2D6 (0.52) | ALDH1A1CYP2D6CYP2C19HSD17B10MEN1 | |
| SCHEMBL295338 | 0.76 | CYP2D6 (0.52) | ALDH1A1CYP2D6CYP2C19HSD17B10MEN1 | |
| SCHEMBL7491379 | 0.76 | CYP2D6 (0.52) | ALDH1A1CYP2D6CYP2C19HSD17B10MEN1 | |
| SCHEMBL2034432 | 0.76 | CYP2D6 (0.52) | ALDH1A1CYP2D6CYP2C19HSD17B10MEN1 | |
| SCHEMBL1153634 | 0.76 | CYP2D6 (0.52) | ALDH1A1CYP2D6CYP2C19HSD17B10MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012113889-A1 | PROCESSES FOR THE STEREOSELECTIVE PREPARATION OF P-CHIRAL FOUR -COORDINATED PHOSPHORUS BORANE COMPOUNDS AND P-CHIRAL THREE-COORDINATED PHOSPHORUS COMPOUNDS | UNIVERSITY COLLEGE DUBLIN (IE) | 2012-08-30 | — | — | WO | disclosed |