Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPA1 | P15085 | 8/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | ALPI | P09923 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.40 |
| ▸ | XIAP | P98170 | 1/20 | 0.40 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.40 |
| ▸ | ALPL | P05186 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ALPG | P10696 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CPA3 | P15088 | 2/20 | 0.38 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.38 |
| ▸ | CPB1 | P15086 | 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 | |
|---|---|---|---|---|
| SCHEMBL2555562 | 0.81 | CPA1 (0.59) | CPA1CYP1A2ALPIPKMPTGS1 | |
| SCHEMBL11081087 | 0.80 | CPA1 (0.53) | CPA1CYP1A2ALPIPKMPTGS1 | |
| SCHEMBL1305447 | 0.78 | CPA1 (0.51) | CPA1CYP1A2ALPIPKMPTGS1 | |
| SCHEMBL11856157 | 0.78 | CPA1 (0.51) | CPA1CYP1A2ALPIPKMPTGS1 | |
| SCHEMBL28007680 | 0.77 | MDM2 (0.58) | CPA1CYP1A2ALPIPKMPTGS1 | |
| SCHEMBL27623586 | 0.74 | CPA1 (0.47) | CPA1CYP1A2ALPIPKMPTGS1 | |
| SCHEMBL1897012 | 0.72 | CPA1 (0.45) | CPA1CYP1A2NPC1TP53RAB9A | |
| SCHEMBL5610245 | 0.71 | CPA1 (0.50) | CPA1CYP1A2ALPIPKMPTGS1 | |
| SCHEMBL5981148 | 0.70 | CPA1 (0.50) | CPA1CYP1A2ALPIPKMPTGS1 | |
| SCHEMBL28259287 | 0.70 | CPA1 (0.50) | CPA1CYP1A2ALPIPKMPTGS1 |
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-107922375-A | Target the antitumoral compounds and its application method of IDH2 mutation | 正大天晴药业集团股份有限公司 | 2018-04-17 | — | — | CN | disclosed |