Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.68 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.56 |
| ▸ | POLB | P06746 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | MYC | P01106 | 4/20 | 0.52 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.49 |
| ▸ | ATM | Q13315 | 2/20 | 0.49 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
| ▸ | GLA | P06280 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | APEX1 | P27695 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL2492855 | 1.00 | NPC1 (0.68) | NPC1PTPN1ALDH1A1ALOX15POLB | |
| SCHEMBL227731 | 0.98 | NPC1 (0.71) | NPC1PTPN1ALDH1A1ALOX15POLB | |
| SCHEMBL1715918 | 0.98 | NPC1 (0.71) | NPC1PTPN1ALDH1A1ALOX15POLB | |
| SCHEMBL8048603 | 0.92 | ALDH1A1 (0.61) | NPC1PTPN1ALDH1A1ALOX15POLB | |
| SCHEMBL28771676 | 0.91 | NPC1 (0.63) | NPC1PTPN1ALDH1A1ALOX15POLB | |
| SCHEMBL10607126 | 0.91 | NPC1 (0.62) | NPC1PTPN1ALDH1A1ALOX15POLB | |
| SCHEMBL28086833 | 0.86 | NPC1 (0.70) | NPC1PTPN1ALDH1A1ALOX15POLB | |
| SCHEMBL3808106 | 0.85 | ALDH1A1 (0.70) | NPC1ALDH1A1ALOX15POLBMYC | |
| Hydrochloric Acid SCHEMBL15048754 | 0.84 | NCF1 (0.52) | NPC1PTPN1ALDH1A1POLBL3MBTL1 | |
| SCHEMBL14528966 | 0.84 | L3MBTL3 (0.59) | NPC1PTPN1KDM4EL3MBTL1TDP1 |
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-113072542-B | ROR gamma t inhibitor and preparation method and application thereof | 广东东阳光药业股份有限公司 | 2024-04-05 | — | — | CN | disclosed |
| WO-2022051286-A1 | N-LINKED GLYCOSYLATION INHIBITORS AND METHODS OF USING SAME | YALE UNIVERSITY (US) | 2022-03-10 | — | — | WO | disclosed |