Trolamine

Trolamine

SCHEMBL14937843

CC(=O)O.CCCCCCCCCCCC(=O)N=CC(=O)O.OCCN(CCO)CCO

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADRA2AADRA2BADRA2CADRB2AGTR1AVPR1AAVPR1BAVPR2BDKRB2CALCRCHRNA3CHRNB4ESR1ESR2GHSRGNRHRGSC1HSPA8MALT1MC1RMC4RNOS1NOS2NOS3OPRK1OXTRRAMP1RAMP2RAMP3SCN5ASSTR1SSTR2SSTR3SSTR4SSTR5dacAdacBdacCfolPftsImrcAmrcBmrdArplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO

The experimentally established mechanism targets of Trolamine. 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
ESR1 known ✓ P03372 1/20 0.38
KDM5A P29375 2/20 0.38
PHF8 Q9UPP1 2/20 0.38
KDM4C Q9H3R0 1/20 0.38
GPR84 Q9NQS5 7/20 0.38
PPARG P37231 7/20 0.38
PPARD Q03181 7/20 0.38
PPARA Q07869 7/20 0.38
HDAC11 Q96DB2 5/20 0.38
TSHR P16473 4/20 0.38
PTPN1 P18031 3/20 0.38
FABP4 P15090 3/20 0.38
ALDH1A1 P00352 2/20 0.38
TLR2 O60603 2/20 0.38
TDP1 Q9NUW8 2/20 0.38
ALOX15 P16050 2/20 0.38
HSD17B10 Q99714 2/20 0.38
SLC22A6 Q4U2R8 1/20 0.38
SLC22A8 Q8TCC7 1/20 0.38
MEN1 O00255 1/20 0.38

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
Acetic Acid SCHEMBL14937855 0.86 GPR84 (0.47) GPR84PPARGPPARDPPARAHDAC11
SCHEMBL7543966 0.84 GPR84 (0.52) GPR84PPARGPPARDPPARAHDAC11
Stearic Acid SCHEMBL11231164 0.79 GPR84 (0.63) KDM5APHF8KDM4CGPR84PPARG
Stearic Acid SCHEMBL22229929 0.78 GPR84 (0.61) KDM5APHF8KDM4CGPR84PPARG
Stearic Acid SCHEMBL22229912 0.78 GPR84 (0.61) KDM5APHF8KDM4CGPR84PPARG
Acetic Acid SCHEMBL6682749 0.77 KDM5A (0.49) KDM5APHF8KDM4CGPR84PPARG
Myristic Acid SCHEMBL2044161 0.76 GPR84 (0.68) KDM5APHF8KDM4CGPR84PPARG
Dodecanoate SCHEMBL323924 0.76 GPR84 (0.68) KDM5APHF8KDM4CGPR84PPARG
Acetic Acid SCHEMBL11801935 0.76 KDM5A (0.47) KDM5APHF8KDM4CGPR84PPARG
Palmitic Acid SCHEMBL50070 0.76 GPR84 (0.68) KDM5APHF8KDM4CGPR84PPARG

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9062137-B2 Block copolymer and antistatic agent comprising same TOHO CHEMICAL INDUSTRY CO., LTD. (JP) 2015-06-23 US disclosed
US-20130123434-A1 BLOCK COPOLYMER AND ANTISTATIC AGENT COMPRISING SAME TOHO CHEMICAL INDUSTRY CO., LTD. (JP) 2013-05-16 US disclosed