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 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 known ✓ | P35354 | 1/20 | 0.32 |
| ▸ | S1PR1 | P21453 | 5/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.32 |
| ▸ | KMO | O15229 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11567880 | 0.89 | S1PR1 (0.37) | S1PR1L3MBTL1TDP1KMO | |
| SCHEMBL11563816 | 0.88 | L3MBTL1 (0.34) | L3MBTL1HPGDNLRP1MAPTSMN1; SMN2 | |
| SCHEMBL11563226 | 0.88 | MAPT (0.42) | HPGDNLRP1MAPTSMN1; SMN2KMT2A | |
| SCHEMBL11601705 | 0.85 | LMNA (0.39) | L3MBTL1CYP2C9HPGDMAPTSMN1; SMN2 | |
| SCHEMBL11464843 | 0.82 | PRKAB2 (0.37) | L3MBTL1HPGDMAPTSMN1; SMN2KMT2A | |
| SCHEMBL11464455 | 0.82 | CNR2 (0.36) | L3MBTL1HPGDMAPTSMN1; SMN2KMT2A | |
| SCHEMBL11463826 | 0.81 | CNR2 (0.36) | L3MBTL1HPGDMAPTSMN1; SMN2KMT2A | |
| SCHEMBL11601818 | 0.80 | L3MBTL1 (0.39) | L3MBTL1CYP2C9HPGDMAPTSMN1; SMN2 | |
| SCHEMBL6732935 | 0.80 | TSHR (0.47) | L3MBTL1CYP2C9HPGDSMN1; SMN2KMT2A | |
| SCHEMBL10510541 | 0.80 | ALDH1A1 (0.38) | L3MBTL1CYP2C9HPGDSMN1; SMN2KMT2A |
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-4134751-A | 4-(5-CHLORO-PYRIDYL-2-OXY)PHENOXY VALERIC ACID AND DERIVATIVES | ISHIHARA SANGYO KAISHA LTD. (JP) | 1979-01-16 | — | — | US | claimed |
| US-4134751-A | 4-(5-CHLORO-PYRIDYL-2-OXY)PHENOXY VALERIC ACID AND DERIVATIVES | ISHIHARA SANGYO KAISHA LTD. (JP) | 1979-01-16 | — | — | US | disclosed |