Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.41 |
| ▸ | AHR | P35869 | 1/20 | 0.40 |
| ▸ | CNR2 | P34972 | 3/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | MGAM | O43451 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | PRNP | P04156 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28495603 | 0.80 | SSTR4 (0.47) | SMN1; SMN2HTTALDH1A1HPGDSSTR4 | |
| SCHEMBL537850 | 0.73 | NCF1 (0.43) | SMN1; SMN2HTTALDH1A1HPGDAHR | |
| SCHEMBL3294200 | 0.73 | NCF1 (0.46) | SMN1; SMN2ALDH1A1HPGDSSTR4CNR2 | |
| SCHEMBL31665931 | 0.73 | NCF1 (0.46) | SMN1; SMN2ALDH1A1HPGDSSTR4CNR2 | |
| SCHEMBL14352068 | 0.72 | KMT2A (0.49) | ALDH1A1CNR2RAB9ANPC1POLB | |
| SCHEMBL11795759 | 0.70 | NCF1 (0.43) | SMN1; SMN2ALDH1A1HPGDSSTR4AHR | |
| SCHEMBL873852 | 0.69 | CNR2 (0.49) | ALDH1A1HPGDAHRCNR2RAB9A | |
| SCHEMBL29723103 | 0.69 | CNR2 (0.49) | ALDH1A1HPGDAHRCNR2RAB9A | |
| SCHEMBL24701997 | 0.69 | L3MBTL1 (0.42) | SMN1; SMN2ALDH1A1HPGDRAB9ANFKB1 | |
| SCHEMBL339520 | 0.68 | PGK1 (0.65) | ALDH1A1CNR2HDAC8MGAMGAA |
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-117897377-A | Difluoromethylation of heterocycles using tetrafluoroethylene | ＡＧＣ株式会社 | 2024-04-16 | — | — | CN | disclosed |