Morpholine

Morpholine

SCHEMBL29207396

C1COCCN1.C1COCCN1.C1COCCN1.C1COCCN1.C1COCCN1.C1COCCN1.C1COCCN1.C1COCCN1.C1COCCN1.C1COCCN1.C1COCCN1.C1COCCN1.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Morpholine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.58
MEN1 O00255 1/20 0.58
KDM4E B2RXH2 1/20 0.58
GAA P10253 1/20 0.58
CYP2C9 P11712 1/20 0.58
FFAR3 O14843 1/20 0.39
LCK P06239 1/20 0.39
FYN P06241 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.37
GABRP O00591 1/20 0.35
GABRD O14764 1/20 0.35
GABRA1 P14867 1/20 0.35
TSHR P16473 1/20 0.35
GABRB1 P18505 1/20 0.35
GABRG2 P18507 1/20 0.35
GABRB3 P28472 1/20 0.35
GABRA5 P31644 1/20 0.35
GABRA3 P34903 1/20 0.35
GABRA2 P47869 1/20 0.35
GABRB2 P47870 1/20 0.35

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.

Compoundsimilaritytop predictedshared targets
Morpholine SCHEMBL219044 1.00 KMT2A (0.58) KMT2AMEN1KDM4EGAACYP2C9
Acetic Acid SCHEMBL10708681 0.97 MEN1 (0.63) KMT2AMEN1KDM4EGAACYP2C9
Morpholine SCHEMBL29076892 0.97 KMT2A (0.55) KMT2AMEN1KDM4EGAACYP2C9
Acetic Acid SCHEMBL10707147 0.97 MEN1 (0.63) KMT2AMEN1KDM4EGAACYP2C9
Acetic Acid SCHEMBL28048691 0.97 KDM4E (0.63) KMT2AMEN1KDM4EGAACYP2C9
Morpholine SCHEMBL15572639 0.95 MEN1 (0.52) KMT2AMEN1KDM4EGAACYP2C9
Morpholine SCHEMBL15572290 0.95 MEN1 (0.52) KMT2AMEN1KDM4EGAACYP2C9
Morpholine SCHEMBL27737341 0.92 GAA (0.61) KMT2AMEN1KDM4EGAACYP2C9
Morpholine SCHEMBL15510851 0.91 MEN1 (0.48) KMT2AMEN1KDM4EGAACYP2C9
Morpholine SCHEMBL28632200 0.91 KMT2A (0.48) KMT2AMEN1KDM4EGAACYP2C9

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110475776-B Tricyclic carboxamides for combating arthropods 拜耳作物科学股份公司 2024-03-19 CN disclosed