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 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTAFR | P25105 | 18/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8928898 | 0.90 | OPRK1 (0.55) | PTAFRCYP3A4ALOX15OPRK1PDE4D | |
| SCHEMBL8928603 | 0.90 | PTAFR (0.43) | PTAFRCYP3A4ALOX15OPRK1PDE4D | |
| SCHEMBL8928650 | 0.89 | PTAFR (0.51) | PTAFRCYP3A4ALOX15OPRK1PDE4D | |
| SCHEMBL8928661 | 0.81 | OPRK1 (0.63) | PTAFRCYP3A4ALOX15OPRK1PDE4D | |
| SCHEMBL8928452 | 0.73 | OPRK1 (0.66) | PTAFRCYP3A4ALOX15OPRK1PDE4D | |
| SCHEMBL8928754 | 0.73 | PTAFR (0.73) | PTAFROPRK1PDE4D | |
| SCHEMBL8928417 | 0.70 | PTAFR (0.66) | PTAFRCYP3A4ALOX15OPRK1PDE4D | |
| SCHEMBL10375810 | 0.69 | PTAFR (0.66) | PTAFROPRK1PDE4D | |
| SCHEMBL9667536 | 0.68 | PTAFR (0.70) | PTAFROPRK1PDE4D | |
| SCHEMBL8928418 | 0.68 | PTAFR (0.77) | PTAFRCYP3A4ALOX15OPRK1PDE4D |
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 |
|---|---|---|---|---|---|---|---|
| EP-0776892-A1 | THIENYLAZOLE COMPOUND AND THIENOTRIAZOLODIAZEPINE COMPOUND | YOSHITOMI PHARMACEUTICAL INDUSTRIES, LTD. (JP) | 1997-06-04 | — | — | EP | disclosed |