Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | CNR1 | P21554 | 2/20 | 0.40 |
| ▸ | CNR2 | P34972 | 2/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL29227106 | 0.84 | TSHR (0.48) | TSHRNPSR1USP2POLBKDM4E | |
| SCHEMBL29227088 | 0.81 | LMNA (0.55) | TSHRNPSR1USP2POLBKDM4E | |
| SCHEMBL29227100 | 0.81 | PRMT5 (0.52) | TSHRNPSR1USP2POLBKDM4E | |
| SCHEMBL3142440 | 0.77 | SIGMAR1 (0.48) | SIGMAR1 | |
| SCHEMBL30873435 | 0.74 | ALDH1A1 (0.47) | TSHRNPSR1USP2KDM4EALDH1A1 | |
| SCHEMBL29227091 | 0.74 | ALDH1A1 (0.47) | TSHRNPSR1USP2KDM4EALDH1A1 | |
| SCHEMBL30873571 | 0.74 | HRH3 (0.53) | SMN1; SMN2NPC1RAB9AMAPTSIGMAR1 | |
| SCHEMBL29227358 | 0.73 | TSHR (0.53) | TSHRNPSR1KDM4EALDH1A1HPGD | |
| SCHEMBL20379519 | 0.72 | TSHR (0.76) | TSHRNPSR1POLBKDM4EALDH1A1 | |
| SCHEMBL15020505 | 0.72 | MAPT (0.50) | TSHRNPSR1USP2POLBKDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-117946031-A | Substituted aromatic phenol derivatives of KNa1.1 channel inhibitors | 北京大学 | 2024-04-30 | — | — | CN | claimed |
| CN-117946031-A | Substituted aromatic phenol derivatives of KNa1.1 channel inhibitors | 北京大学 | 2024-04-30 | — | — | CN | disclosed |