Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Methylpyrrolidone. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.90 |
| ▸ | BRD2 | P25440 | 1/20 | 0.90 |
| ▸ | INMT | O95050 | 2/20 | 0.44 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.38 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | PSMD14 | O00487 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.35 |
| ▸ | IDE | P14735 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA3 | P07451 | 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 | |
|---|---|---|---|---|
| Methylpyrrolidone SCHEMBL9308724 | 0.95 | — | — | |
| Methylpyrrolidone SCHEMBL28659452 | 0.95 | BRD4 (0.90) | BRD4BRD2INMTPIK3CDKMT2A | |
| Methylpyrrolidone SCHEMBL27917614 | 0.95 | BRD4 (0.90) | BRD4BRD2INMTPIK3CDKMT2A | |
| Methylpyrrolidone SCHEMBL28250382 | 0.95 | BRD4 (0.90) | BRD4BRD2INMTPIK3CDKMT2A | |
| Methylpyrrolidone SCHEMBL11304311 | 0.95 | BRD4 (0.90) | BRD4BRD2INMTPIK3CDKMT2A | |
| Methylpyrrolidone SCHEMBL28847596 | 0.95 | — | — | |
| Methylpyrrolidone SCHEMBL28665050 | 0.95 | — | — | |
| Methylpyrrolidone SCHEMBL487 | 0.95 | — | — | |
| Methylpyrrolidone SCHEMBL1255511 | 0.95 | BRD4 (1.00) | BRD4BRD2INMTPIK3CDKMT2A | |
| Methylpyrrolidone SCHEMBL8055062 | 0.95 | BRD4 (1.00) | BRD4BRD2INMTPIK3CDKMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112795038-B | Preparation method of flexible bio-based film material and product thereof | 仲恺农业工程学院 | 2023-01-17 | — | — | CN | claimed |
| CN-112795038-A | Preparation method of flexible bio-based film material and product thereof | 仲恺农业工程学院 | 2021-05-14 | — | — | CN | claimed |
| CN-112795038-B | Preparation method of flexible bio-based film material and product thereof | 仲恺农业工程学院 | 2023-01-17 | — | — | CN | disclosed |
| CN-112795038-A | Preparation method of flexible bio-based film material and product thereof | 仲恺农业工程学院 | 2021-05-14 | — | — | CN | disclosed |