Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.34 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
| ▸ | TACR2 | P21452 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.34 |
| ▸ | TSHR | P16473 | 3/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Ethoxycarbonyl Group SCHEMBL27606185 | 0.87 | NPSR1 (0.38) | KMT2AALOX12POLBNPC1SMN1; SMN2 | |
| Ethoxycarbonyl Group SCHEMBL28264125 | 0.86 | SMN1; SMN2 (0.35) | KMT2APTGS2NPC1TSHRSMN1; SMN2 | |
| SCHEMBL30578709 | 0.83 | KMT2A (0.44) | KMT2AALOX12POLBNPC1MAPK1 | |
| SCHEMBL29291077 | 0.81 | ALOX12 (0.40) | KMT2AALOX12POLBNPC1MAPK1 | |
| Ethoxycarbonyl Group SCHEMBL28826453 | 0.78 | NOTUM (0.48) | PTGS2NPC1MAPK1TSHRLMNA | |
| 1,4-Dichlorobenzene SCHEMBL27842897 | 0.74 | HSD17B10 (0.42) | KMT2APOLBPTGS2TACR2TSHR | |
| SCHEMBL29082344 | 0.71 | POLB (0.46) | KMT2AALOX12POLBNPC1MAPK1 | |
| Ethoxycarbonyl Group SCHEMBL28015510 | 0.70 | NOTUM (0.31) | — | |
| SCHEMBL23997451 | 0.70 | NOTUM (0.30) | LMNAMAPT | |
| Ethoxycarbonyl Group SCHEMBL27720341 | 0.69 | — | — |
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-116768877-A | ISR inhibitor and preparation method and application thereof | 中国药科大学 | 2023-09-19 | — | — | CN | disclosed |