Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CREBBP | Q92793 | 8/20 | 0.52 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | ACHE | P22303 | 2/20 | 0.42 |
| ▸ | PARP14 | Q460N5 | 1/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | ALKBH1 | Q13686 | 1/20 | 0.40 |
| ▸ | LDHA | P00338 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL947911 | 0.88 | CREBBP (0.55) | CREBBPKLKB1TDP1ALDH1A1ACHE | |
| SCHEMBL949676 | 0.88 | CREBBP (0.55) | CREBBPKLKB1TDP1ALDH1A1ACHE | |
| SCHEMBL12913216 | 0.88 | CREBBP (0.55) | CREBBPKLKB1TDP1ALDH1A1ACHE | |
| SCHEMBL949190 | 0.85 | CREBBP (0.52) | CREBBPKLKB1TDP1ALDH1A1ACHE | |
| SCHEMBL947800 | 0.85 | CREBBP (0.52) | CREBBPKLKB1TDP1ALDH1A1ACHE | |
| SCHEMBL949139 | 0.85 | CREBBP (0.52) | CREBBPKLKB1TDP1ALDH1A1ACHE | |
| SCHEMBL20768103 | 0.82 | KLKB1 (0.55) | CREBBPKLKB1BRD4MAPTALKBH1 | |
| SCHEMBL28008347 | 0.81 | KLKB1 (0.42) | CREBBPKLKB1ALDH1A1ACHEPARP1 | |
| SCHEMBL30022092 | 0.81 | TSHR (0.49) | KLKB1ALDH1A1CYP3A4MAPTTSHR | |
| SCHEMBL23212254 | 0.79 | CYP1A2 (0.55) | CREBBPKLKB1ALDH1A1CYP3A4MAPT |
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-112341390-B | Compound for preparing targeted histone methyltransferase EZH2 covalent inhibitor and preparation method and application thereof | 四川大学 | 2022-08-23 | — | — | CN | disclosed |