Known targets — ChEMBL curated mechanism
ABCC8ACEADORA1ADORA2AADORA2BADORA3ALDH5A1ALOX5ALOX5APATP4AATP4BBRAFCA1CA12CA2CA4CYSLTR1DHFRDPEP1EDNRAEDNRBESR2F10FDPSFGF1GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTGNRHRGSC1HMGCRIMPDH1IMPDH2KCNJ11LY96NOD2NR3C1NS3NS4ANS5bP2RY1P2RY12P2RY2P2RY4P2RY6PBP2XPDE3APDE3BPDE4APDE4BPDE4CPDE4DPDK1PDK2PDK3PDK4PPARGPPATPTGIRPTGS1PTGS2RAF1RYR1RYR3SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASERPINC1SLC12A1SLC12A3SYKTHRATHRBTLR3TLR4TLR9TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8TYMSVKORC1XDHblablaIMP-1blaOXA-33blaOXA-58blaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAfolPfolP1ftsIfusAgaggyrAgyrBmecAmrcAmrcBmrdApbp1apbp1bpbp2pbp2apbp2bpbp3pbp4pbpApbpBpbpCpbpFpolponBrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpoArpoBrpoCrpoZrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
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 | 0.39 |
| ▸ | HPGD | P15428 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | GMNN | O75496 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | APEX1 | P27695 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6732935 | 0.88 | TSHR (0.47) | LMNAHPGDALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL11601818 | 0.88 | L3MBTL1 (0.39) | LMNAHPGDALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL9763694 | 0.88 | TSHR (0.47) | LMNAHPGDALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL10510541 | 0.88 | ALDH1A1 (0.38) | LMNAHPGDALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL10760195 | 0.87 | ALDH1A1 (0.40) | LMNAHPGDALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL11264676 | 0.87 | FPR2 (0.39) | LMNAHPGDALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL10792400 | 0.87 | ALDH1A1 (0.37) | LMNAHPGDALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL732544 | 0.85 | L3MBTL1 (0.46) | LMNAHPGDALDH1A1SMN1; SMN2MAPT | |
| SCHEMBL11440040 | 0.85 | ALDH1A1 (0.38) | LMNAHPGDALDH1A1SMN1; SMN2CYP1A2 | |
| SCHEMBL11564004 | 0.85 | S1PR1 (0.35) | HPGDALDH1A1SMN1; SMN2MAPTL3MBTL1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4046553-A | HERBICIDAL COMPOUND, HERBICIDAL COMPOSITION CONTAINING THE SAME AND METHOD OF USE THEREOF | ISHIHARA SANGYO KAISHA, LTD. (JA) | 1977-09-06 | — | — | US | claimed |
| US-4115102-A | PYRIDYLOXYPHENOXYALKANE CARBOXYLIC ACIDS | ISHIHARA SANGYO KAISHA, LTD. (JP) | 1978-09-19 | — | — | US | disclosed |
| US-4092151-A | ALPHA-(4-(5-MONOSUBSTITUTED OR 3,5-DI-SUBSTITUTED-PYRIDYL-2-OXY)PHENOXY)ALKANECARBOXYLIC ACID AND DERIVATIVES | ISHIHARA SANGYO KAISHA, LTD. (JA) | 1978-05-30 | — | — | US | disclosed |
| US-4083714-A | CONTROLLING WEEDS | ISHIHARA SANGYO KAISHA, LTD. (JA) | 1978-04-11 | — | — | US | disclosed |
| US-4046553-A | HERBICIDAL COMPOUND, HERBICIDAL COMPOSITION CONTAINING THE SAME AND METHOD OF USE THEREOF | ISHIHARA SANGYO KAISHA, LTD. (JA) | 1977-09-06 | — | — | US | disclosed |