Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | NPC1 | O15118 | 3/20 | 0.45 |
| ▸ | RAB9A | P51151 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.44 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | DDX3X | O00571 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1197657 | 0.80 | PKM (0.68) | PKMALDH1A1CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL374672 | 0.77 | SLC6A2 (0.60) | PKMSMN1; SMN2CHRNB4CHRNA3LMNA | |
| SCHEMBL3249583 | 0.74 | TACR1 (0.52) | PKMALDH1A1KMT2ACHRNB4CHRNA3 | |
| SCHEMBL18758028 | 0.74 | MEN1 (0.49) | ALDH1A1KMT2ANPC1RAB9ASMN1; SMN2 | |
| SCHEMBL31509610 | 0.74 | PKM (0.54) | PKMALDH1A1KMT2ANPC1RAB9A | |
| SCHEMBL25335598 | 0.74 | SLC6A2 (0.59) | PKMCHRNB4CHRNA3 | |
| SCHEMBL7057566 | 0.73 | CHRNB4 (0.57) | PKMCHRNB4CHRNA3LMNA | |
| SCHEMBL25336072 | 0.73 | SLC6A2 (0.57) | PKMCHRNB4CHRNA3 | |
| SCHEMBL924103 | 0.73 | SMN1; SMN2 (0.63) | ALDH1A1KMT2ASMN1; SMN2MEN1DDX3X | |
| SCHEMBL25336074 | 0.72 | SLC6A2 (0.56) | PKMALDH1A1CHRNB4CHRNA3MAPT |
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-113677680-B | EGFR inhibitor, composition and application thereof | 贝达药业股份有限公司 | 2024-05-10 | — | — | CN | disclosed |