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 | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 4/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | HTR1D | P28221 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 6/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 6/20 | 0.40 |
| ▸ | ADRA1B | P35368 | 6/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 4/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.40 |
| ▸ | RAD52 | P43351 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HTT | P42858 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7141308 | 0.81 | ADRA1A (0.47) | HTR1DADRA1DADRA1AADRA1BADRA2C | |
| SCHEMBL31088162 | 0.80 | HTR1D (0.54) | HTR1DADRA2CADRA2AHTR1AADRA2B | |
| Sulfuric Acid SCHEMBL7141352 | 0.79 | NISCH (0.57) | LMNACYP2D6HTR1DKDM4ETSHR | |
| Sulfuric Acid SCHEMBL7141355 | 0.79 | NISCH (0.57) | LMNACYP2D6HTR1DKDM4ETSHR | |
| SCHEMBL7141180 | 0.79 | ADRA1A (0.47) | HTR1DADRA1DADRA1AADRA1BADRA2C | |
| SCHEMBL7141177 | 0.79 | ADRA1A (0.47) | HTR1DADRA1DADRA1AADRA1BADRA2C | |
| Heptane SCHEMBL8501523 | 0.78 | MCHR1 (0.56) | LMNACYP2C19KDM4ECYP3A4TSHR | |
| SCHEMBL3451047 | 0.78 | HTR1D (0.56) | HTR1DADRA2CADRA2AHTR1AADRA2B | |
| SCHEMBL10491831 | 0.78 | HTR1D (0.56) | HTR1DADRA2CADRA2AHTR1AADRA2B | |
| Octane SCHEMBL356741 | 0.78 | MCHR1 (0.56) | LMNACYP2C19KDM4ECYP3A4TSHR |
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-6521683-B1 | Antistatic agents and resin compositions incorporated therein | WITCO CORPORATION | 2003-02-18 | — | — | US | disclosed |
| EP-1177254-A1 | ANTISTATIC AGENTS AND RESIN COMPOSITIONS INCORPORATED THEREIN | Crompton Corporation (US) | 2002-02-06 | — | — | EP | disclosed |
| WO-2000064970-A1 | ANTISTATIC AGENTS AND RESIN COMPOSITIONS INCORPORATED THEREIN | CROMPTON CORPORATION (US) | 2000-11-02 | — | — | WO | disclosed |