Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.54 |
| ▸ | GLA | P06280 | 2/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.40 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.40 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28632389 | 1.00 | HTT (0.54) | HTTGLAL3MBTL1ALDH1A1KDM4E | |
| SCHEMBL29658525 | 0.87 | HTT (0.56) | HTTGLAL3MBTL1ALDH1A1KDM4E | |
| SCHEMBL19717030 | 0.87 | HTT (0.56) | HTTGLAL3MBTL1ALDH1A1KDM4E | |
| SCHEMBL19717463 | 0.82 | HTT (0.49) | HTTGLAL3MBTL1ALDH1A1KDM4E | |
| SCHEMBL13211659 | 0.81 | KMT2A (0.46) | HTTGLAL3MBTL1ALDH1A1KDM4E | |
| SCHEMBL19717043 | 0.76 | KDM4E (0.51) | HTTGLAL3MBTL1ALDH1A1KDM4E | |
| SCHEMBL19716920 | 0.76 | ALDH1A1 (0.47) | HTTGLAL3MBTL1ALDH1A1KDM4E | |
| SCHEMBL29658711 | 0.76 | ALDH1A1 (0.47) | HTTGLAL3MBTL1ALDH1A1KDM4E | |
| SCHEMBL29658703 | 0.76 | KDM4E (0.51) | HTTGLAL3MBTL1ALDH1A1KDM4E | |
| SCHEMBL19717501 | 0.74 | ALDH1A1 (0.59) | HTTGLAL3MBTL1ALDH1A1KDM4E |
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-113292489-B | Preparation method of dichlorodialkyl nicotinonitrile | 泓博智源(开原)药业有限公司 | 2022-08-30 | — | — | CN | disclosed |