Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.60 |
| ▸ | NPC1 | O15118 | 1/20 | 0.60 |
| ▸ | GAA | P10253 | 2/20 | 0.59 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | LNPEP | Q9UIQ6 | 6/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | CA1 | P00915 | 1/20 | 0.56 |
| ▸ | CA2 | P00918 | 1/20 | 0.56 |
| ▸ | BACE1 | P56817 | 2/20 | 0.55 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | ERAP2 | Q6P179 | 2/20 | 0.54 |
| ▸ | MEN1 | O00255 | 3/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.52 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL23466750 | 1.00 | RAB9A (0.60) | RAB9ANPC1GAAL3MBTL1ALDH1A1 | |
| Hydrochloric Acid SCHEMBL29758042 | 0.99 | RAB9A (0.59) | RAB9ANPC1GAAL3MBTL1ALDH1A1 | |
| SCHEMBL19805597 | 0.88 | MAPT (0.60) | RAB9ANPC1GAAALDH1A1MAPT | |
| SCHEMBL28753025 | 0.88 | MAPT (0.60) | RAB9ANPC1GAAALDH1A1MAPT | |
| SCHEMBL8120133 | 0.88 | SLC7A5 (0.56) | ALDH1A1LNPEPLMNABACE1SLC7A5 | |
| SCHEMBL2995175 | 0.87 | SLC7A5 (0.56) | RAB9ANPC1LNPEPBACE1SLC7A5 | |
| SCHEMBL2995178 | 0.87 | SLC7A5 (0.56) | RAB9ANPC1LNPEPBACE1SLC7A5 | |
| SCHEMBL23486647 | 0.87 | NAMPT (0.55) | GAAL3MBTL1ALDH1A1LNPEPMAPT | |
| Hydrochloric Acid SCHEMBL23466585 | 0.86 | SLC7A5 (0.55) | RAB9ANPC1LNPEPBACE1SLC7A5 | |
| SCHEMBL2994483 | 0.86 | BACE1 (0.57) | RAB9ANPC1BACE1MEN1KMT2A |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114539158-B | FXIa inhibitor compound and preparation method and application thereof | 沈阳药科大学 | 2023-12-08 | — | — | CN | disclosed |
| CN-114539158-A | FXIa inhibitor compound and preparation method and application thereof | 沈阳药科大学 | 2022-05-27 | — | — | CN | disclosed |
| CN-109721539-B | Pyrazole amide derivative and preparation method and application thereof | 天津药物研究院有限公司 | 2021-07-09 | — | — | CN | disclosed |
| WO-2021110076-A1 | OXAMIDE DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF IN MEDICINE | 深圳信立泰药业股份有限公司 | 2021-06-10 | — | — | WO | disclosed |
| CN-109721539-A | Pyrazole amide analog derivative and its preparation method and application | 天津药物研究院有限公司 | 2019-05-07 | — | — | CN | disclosed |