Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | KLK7 | P49862 | 1/20 | 0.40 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 4/20 | 0.39 |
| ▸ | CA1 | P00915 | 4/20 | 0.39 |
| ▸ | CA2 | P00918 | 4/20 | 0.39 |
| ▸ | CA4 | P22748 | 4/20 | 0.39 |
| ▸ | CA6 | P23280 | 4/20 | 0.39 |
| ▸ | CA5A | P35218 | 4/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19976434 | 0.92 | TSHR (0.52) | TSHRLMNAKMT2ABCHEALDH1A1 | |
| SCHEMBL30040993 | 0.90 | ALDH1A1 (0.47) | TSHRLMNAKMT2ABCHEALDH1A1 | |
| SCHEMBL19980839 | 0.88 | BCHE (0.47) | BCHESLC6A2KLK7KLK5PTPN1 | |
| SCHEMBL21339695 | 0.87 | BCHE (0.48) | TSHRLMNAKMT2ABCHEALDH1A1 | |
| SCHEMBL26835221 | 0.87 | BCHE (0.48) | TSHRLMNAKMT2ABCHEALDH1A1 | |
| SCHEMBL22582956 | 0.84 | BCHE (0.45) | BCHESLC6A2KLK7KLK5PTPN1 | |
| SCHEMBL14362882 | 0.82 | BCHE (0.46) | BCHEALDH1A1POLBSLC6A2GAA | |
| SCHEMBL14362878 | 0.82 | BCHE (0.46) | BCHEALDH1A1POLBSLC6A2GAA | |
| SCHEMBL26354126 | 0.81 | ALDH1A1 (0.46) | TSHRLMNAKMT2ABCHEALDH1A1 | |
| SCHEMBL24145415 | 0.81 | CA2 (0.47) | TSHRLMNACYP2D6POLBGAA |
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-9919055-B2 | Sugar-linker-drug conjugates | ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) | 2018-03-20 | — | — | US | disclosed |