Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.47 |
| ▸ | GPR119 | Q8TDV5 | 5/20 | 0.44 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.44 |
| ▸ | MET | P08581 | 1/20 | 0.43 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.42 |
| ▸ | NAMPT | P43490 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | USP30 | Q70CQ3 | 2/20 | 0.41 |
| ▸ | NR1D1 | P20393 | 2/20 | 0.40 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21247447 | 1.00 | TXNRD1 (0.47) | TXNRD1GPR119PIK3CDMETPRKCQ | |
| SCHEMBL28901520 | 1.00 | TXNRD1 (0.47) | TXNRD1GPR119PIK3CDMETPRKCQ | |
| SCHEMBL28480884 | 0.94 | MET (0.42) | TXNRD1GPR119PIK3CDMETPRKCQ | |
| SCHEMBL28469727 | 0.94 | TXNRD1 (0.51) | TXNRD1GPR119METNAMPTPOLB | |
| SCHEMBL20471639 | 0.84 | TXNRD1 (0.47) | TXNRD1PAX8ALDH1A1LMNAMAPT | |
| SCHEMBL21247456 | 0.84 | TXNRD1 (0.47) | TXNRD1PAX8ALDH1A1LMNAMAPT | |
| SCHEMBL20471643 | 0.84 | TXNRD1 (0.47) | TXNRD1PAX8ALDH1A1LMNAMAPT | |
| SCHEMBL15917743 | 0.84 | GPR119 (0.47) | GPR119PIK3CDNAMPTPOLBUSP30 | |
| SCHEMBL20471646 | 0.79 | SMN1; SMN2 (0.49) | TXNRD1PAX8ALDH1A1LMNAMAPT | |
| SCHEMBL14335034 | 0.78 | PIK3CD (0.52) | GPR119PIK3CD |
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 |
|---|---|---|---|---|---|---|---|
| CN-111867587-A | Thioredoxin reductase inhibitors for the treatment of cancer | 信达制药公司 | 2020-10-30 | — | — | CN | disclosed |