Known targets — ChEMBL curated mechanism
ABL1BMXBRAFBTKCHRNA4CHRNB2CSNK1EEGFRERBB2F10FLT1FLT3FLT4IGF1RINSRITKJAK3KDRKITOPRM1PARP1PARP2PDGFRBPIK3CDRAF1RETSLC18A2TECTXKdacAdacBdacCftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
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 | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 6/20 | 0.40 |
| ▸ | LMNA | P02545 | 5/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | HKDC1 | Q2TB90 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | RRM1 | P23921 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 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 | |
|---|---|---|---|---|
| SCHEMBL8861416 | 0.79 | LMNA (0.37) | HTTLMNAMAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL8761654 | 0.71 | CYP2D6 (0.36) | LMNASMN1; SMN2L3MBTL1CYP2D6MEN1 | |
| SCHEMBL10886630 | 0.71 | L3MBTL1 (0.39) | HTTLMNASMN1; SMN2ALDH1A1TDP1 | |
| SCHEMBL18794810 | 0.70 | ALDH1A1 (0.33) | ALDH1A1TDP1CYP2C19MEN1KMT2A | |
| SCHEMBL11151788 | 0.69 | PIK3CA (0.46) | HTTLMNAMAPTSMN1; SMN2ALDH1A1 | |
| Naphthalene SCHEMBL29169688 | 0.68 | SMN1; SMN2 (0.64) | HTTLMNAMAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL11699608 | 0.67 | ALDH1A1 (0.43) | HTTLMNAMAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL11699615 | 0.67 | ALDH1A1 (0.43) | HTTLMNAMAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL28351111 | 0.67 | GAA (0.45) | HTTLMNAMAPTSMN1; SMN2ALDH1A1 | |
| SCHEMBL6755568 | 0.66 | ALDH1A1 (0.51) | HTTLMNAMAPTSMN1; SMN2ALDH1A1 |
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-1071834-A | The compositions and the method for treatment cancer | FUJI PHOTO FILM CO LTD (JP) | 1993-05-12 | — | — | CN | disclosed |