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 | |
|---|---|---|---|---|
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | SNCA | P37840 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1041514 | 0.80 | MEN1 (0.47) | GPR84L3MBTL1KDM4ELMNAALDH1A1 | |
| Trifluoromethanesulfonic Acid SCHEMBL547978 | 0.80 | MEN1 (0.43) | GPR84KDM4ELMNAALDH1A1MAPT | |
| SCHEMBL26673761 | 0.79 | PTGS2 (0.45) | GPR84L3MBTL1KDM4ELMNAALDH1A1 | |
| SCHEMBL26673749 | 0.78 | HPRT1 (0.46) | L3MBTL1KDM4ELMNAALDH1A1MAPT | |
| Perflubutane SCHEMBL6029410 | 0.78 | MEN1 (0.41) | GPR84KDM4ELMNAALDH1A1MAPT | |
| SCHEMBL6761290 | 0.76 | CYP2D6 (0.45) | L3MBTL1KDM4ELMNAALDH1A1MAPT | |
| SCHEMBL6757914 | 0.76 | SMN1; SMN2 (0.41) | L3MBTL1KDM4ELMNAALDH1A1MAPT | |
| SCHEMBL25613450 | 0.76 | PTGS2 (0.49) | L3MBTL1KDM4ELMNAALDH1A1MAPT | |
| SCHEMBL26705914 | 0.76 | PTGS2 (0.49) | L3MBTL1KDM4ELMNAALDH1A1MAPT | |
| SCHEMBL6762839 | 0.74 | SMN1; SMN2 (0.42) | L3MBTL1KDM4ELMNAALDH1A1MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7072564-B2 | Waveguide compositions and waveguides formed therefrom | ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) | 2006-07-04 | — | — | US | disclosed |
| US-20050111808-A1 | Waveguide compositions and waveguides formed therefrom | ROHM AND HAAS ELECTRONIC MATERIALS, L.L.C. (US) | 2005-05-26 | — | — | US | disclosed |