Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC7A5 | Q01650 | 5/20 | 0.57 |
| ▸ | SLC6A4 | P31645 | 6/20 | 0.54 |
| ▸ | SLC6A2 | P23975 | 5/20 | 0.54 |
| ▸ | SLC6A3 | Q01959 | 4/20 | 0.54 |
| ▸ | KCNK2 | O95069 | 2/20 | 0.54 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.54 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 4/20 | 0.50 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | MTOR | P42345 | 2/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | HTR2C | P28335 | 2/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL4865335 | 0.86 | SRD5A2 (0.42) | SLC7A5SLC6A4SLC6A2SLC6A3KCNK2 | |
| SCHEMBL8466535 | 0.83 | SLC7A5 (0.40) | SLC7A5SLC6A4SLC6A2SLC6A3KCNK2 | |
| SCHEMBL3291158 | 0.82 | SLC6A4 (0.39) | SLC7A5SLC6A4CYP2C19CYP3A4TSHR | |
| SCHEMBL8163510 | 0.80 | CYP1A2 (0.42) | SLC7A5CYP2C19CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL3299568 | 0.77 | SLC6A4 (0.46) | SLC7A5SLC6A4SLC6A2SLC6A3MEN1 | |
| SCHEMBL3294416 | 0.77 | CA4 (0.46) | MEN1KMT2ALMNANPC1RAB9A | |
| SCHEMBL3295214 | 0.77 | SLC6A4 (0.46) | SLC6A4SLC6A2SLC6A3PPARGPPARA | |
| SCHEMBL3294031 | 0.77 | NPSR1 (0.41) | SLC7A5MEN1KMT2ALMNATSHR | |
| SCHEMBL7239564 | 0.77 | SLC7A5 (0.68) | SLC7A5SLC6A4SLC6A2SLC6A3KCNK2 | |
| SCHEMBL8625767 | 0.75 | ALDH1A3 (0.50) | KMT2ALMNARAB9AKDM4EDRD1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7732365-B2 | Enantioselective amination and etherification | YALE UNIVERSITY (US) | 2010-06-08 | — | — | US | disclosed |
| US-20060199728-A1 | Enantioselective amination and etherification | YALE UNIVERSITY (US) | 2006-09-07 | — | — | US | disclosed |