Propofol

Propofol

SCHEMBL2683597

CC(C)c1cccc(C(C)C)c1O.Cc1ccc(C(C)C)c(O)c1

nearest known ligand 0.78

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQ

The experimentally established mechanism targets of Propofol. 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
GABRA1 known ✓ P14867 5/20 0.63
GABRB1 known ✓ P18505 4/20 0.63
GABRB2 known ✓ P47870 3/20 0.63
GABRG2 known ✓ P18507 1/20 0.63
GABRB3 known ✓ P28472 1/20 0.63
GABRA5 known ✓ P31644 1/20 0.63
GABRA3 known ✓ P34903 1/20 0.63
GABRA2 known ✓ P47869 1/20 0.63
GABRA4 known ✓ P48169 1/20 0.63
GABRA6 known ✓ Q16445 1/20 0.63
LMNA P02545 4/20 0.78
SLC6A2 P23975 2/20 0.78
HTR2B P41595 2/20 0.78
TRPA1 O75762 2/20 0.78
CHRM1 P11229 1/20 0.78
ADRA1A P35348 1/20 0.78
CA1 P00915 2/20 0.63
CA2 P00918 2/20 0.63
CYP1A2 P05177 2/20 0.63
CYP3A4 P08684 2/20 0.63

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
Thymol SCHEMBL22165 0.88 LMNA (1.00) LMNASLC6A2HTR2BTRPA1CHRM1
Thymol SCHEMBL29579824 0.88 LMNA (1.00) LMNASLC6A2HTR2BTRPA1CHRM1
Thymol SCHEMBL1867982 0.88 LMNA (1.00) LMNASLC6A2HTR2BTRPA1CHRM1
Thymol SCHEMBL30332213 0.88 LMNA (1.00) LMNASLC6A2HTR2BTRPA1CHRM1
Thymol SCHEMBL23932298 0.86 LMNA (0.95) LMNASLC6A2HTR2BTRPA1CHRM1
Thymol SCHEMBL11054439 0.86 LMNA (0.95) LMNASLC6A2HTR2BTRPA1CHRM1
Thymol SCHEMBL5905814 0.86 LMNA (0.95) LMNASLC6A2HTR2BTRPA1CHRM1
Thymol SCHEMBL7074408 0.86 LMNA (0.95) LMNASLC6A2HTR2BTRPA1CHRM1
Thymol SCHEMBL8506977 0.86 LMNA (0.95) LMNASLC6A2HTR2BTRPA1CHRM1
Thymol SCHEMBL1668335 0.86 LMNA (0.95) LMNASLC6A2HTR2BTRPA1CHRM1

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190167632-A1 METHODS OF TREATING AND PREVENTING/REDUCING THE LIKELIHOOD OF MESIAL TEMPORAL LOBE EPILEPSY (TLE) MUELLER WOLFGANG S (US) 2019-06-06 US disclosed
US-10238622-B2 Methods of treating and preventing/reducing the likelihood of Mesial temporal lobe epilepsy (TLE) THE REGENTS OF THE UNIVERSITY OF NEW MEXICO 2019-03-26 US disclosed
US-20120115919-A1 METHODS OF TREATING AND PREVENTING/REDUCING THE LIKELIHOOD OF MESIAL TEMPORAL LOBE EPILEPSY (TLE) THE REGENTS OF THE UNIVERSITY OF NEW MEXICO 2012-05-10 US disclosed