Known targets — ChEMBL curated mechanism
GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of None. 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 | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.53 |
| ▸ | FUT7 | Q11130 | 2/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
| ▸ | XDH | P47989 | 1/20 | 0.53 |
| ▸ | GFER | P55789 | 1/20 | 0.53 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.53 |
| ▸ | RELA | Q04206 | 1/20 | 0.53 |
| ▸ | SERPINE1 | P05121 | 10/20 | 0.52 |
| ▸ | NSD2 | O96028 | 2/20 | 0.46 |
| ▸ | POLA1 | P09884 | 1/20 | 0.46 |
| ▸ | ANTXR2 | P58335 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.45 |
| ▸ | CA1 | P00915 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29249932 | 0.96 | POLB (0.53) | POLBKDM4ELMNATDP1FUT7 | |
| SCHEMBL28136833 | 0.82 | POLB (0.55) | POLBKDM4ELMNATDP1FUT7 | |
| Gallic Acid SCHEMBL28256203 | 0.75 | KDM4E (0.74) | POLBKDM4ELMNATDP1FUT7 | |
| SCHEMBL27939239 | 0.73 | KDM4E (0.67) | POLBKDM4ELMNATDP1FUT7 | |
| SCHEMBL1668506 | 0.73 | KDM4E (0.67) | POLBKDM4ELMNATDP1FUT7 | |
| SCHEMBL22397287 | 0.73 | SERPINE1 (0.63) | POLBKDM4ELMNATDP1FUT7 | |
| SCHEMBL28765856 | 0.72 | KDM4E (0.64) | POLBKDM4ELMNATDP1FUT7 | |
| Gallic Acid SCHEMBL29249934 | 0.71 | KDM4E (0.48) | POLBKDM4ELMNATDP1FUT7 | |
| SCHEMBL18648419 | 0.70 | KDM4E (0.61) | POLBKDM4ELMNATDP1FUT7 | |
| SCHEMBL7639031 | 0.70 | KDM4E (0.61) | POLBKDM4ELMNATDP1FUT7 |
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-108801956-A | Absorbing process of the chitosan to asparagine in sugarcane juice | 广西科技大学 | 2018-11-13 | — | — | CN | disclosed |