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 | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 3/20 | 0.40 |
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | SNCA | P37840 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL114362 | 1.00 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2LMNATDP1MAPT | |
| SCHEMBL4446976 | 0.88 | SMN1; SMN2 (0.55) | ALDH1A1SMN1; SMN2LMNATDP1MAPT | |
| Sulfuric Acid SCHEMBL482696 | 0.84 | TRPA1 (0.43) | ALDH1A1SMN1; SMN2LMNATDP1MAPT | |
| Sulfuric Acid SCHEMBL3797183 | 0.84 | TRPA1 (0.43) | ALDH1A1SMN1; SMN2LMNATDP1MAPT | |
| SCHEMBL7741668 | 0.82 | CA1 (0.41) | ALDH1A1SMN1; SMN2LMNAMAPTCYP2D6 | |
| SCHEMBL27475054 | 0.81 | ALDH1A1 (0.46) | ALDH1A1SMN1; SMN2LMNATDP1MAPT | |
| O-Xylene SCHEMBL30856513 | 0.80 | SMN1; SMN2 (0.56) | ALDH1A1SMN1; SMN2LMNATDP1MAPT | |
| O-Xylene SCHEMBL5134935 | 0.80 | SMN1; SMN2 (0.56) | ALDH1A1SMN1; SMN2LMNATDP1MAPT | |
| Sulfuric Acid SCHEMBL15345267 | 0.79 | HTT (0.39) | ALDH1A1SMN1; SMN2LMNATDP1MAPT | |
| SCHEMBL10905332 | 0.79 | SMN1; SMN2 (0.50) | ALDH1A1SMN1; SMN2LMNATDP1MAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7163778-B2 | Anti-reflection film material and a substrate having an anti-reflection film and a method for forming a pattern | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2007-01-16 | — | — | US | disclosed |
| US-20060263702-A1 | Composition for forming intermediate layer containing sylylphenylene-based polymer and pattern-forming method | TOKYO OHKA KOGYO CO., LTD. (JP) | 2006-11-23 | — | — | US | disclosed |
| US-20040191479-A1 | Anti-reflection film material and a substrate having an anti-reflection film and a method for forming a pattern | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2004-09-30 | — | — | US | disclosed |