Quinoline

Quinoline

SCHEMBL5874841

O=C(O)/C=C\C(=O)O.c1ccc2ncccc2c1.c1ccc2ncccc2c1

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2BTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3MPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PPARGSLC6A2SLC6A3SLC6A4SMOTYK2pol

The experimentally established mechanism targets of Quinoline. 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
ALDH1A1 P00352 5/20 0.65
KDM4E B2RXH2 6/20 0.54
LMNA P02545 1/20 0.54
RAB9A P51151 2/20 0.54
CYP3A4 P08684 2/20 0.51
RECQL P46063 1/20 0.50
HSD17B10 Q99714 1/20 0.47
PABPC1 P11940 1/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
MAPT P10636 2/20 0.45
NPC1 O15118 1/20 0.45
POLB P06746 1/20 0.45
MGAM O43451 2/20 0.44
CASP1 P29466 1/20 0.44
CASP7 P55210 1/20 0.44
BCAT1 P54687 1/20 0.43
MCL1 Q07820 1/20 0.43
GAA P10253 1/20 0.43
ALOX15 P16050 1/20 0.42

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
Quinoline SCHEMBL11274861 1.00 ALDH1A1 (0.65) ALDH1A1KDM4ELMNARAB9ACYP3A4
Quinoline SCHEMBL7884120 1.00 ALDH1A1 (0.65) ALDH1A1KDM4ELMNARAB9ACYP3A4
Quinoline SCHEMBL27293512 1.00 ALDH1A1 (0.65) ALDH1A1KDM4ELMNARAB9ACYP3A4
Quinoline SCHEMBL27800002 1.00 ALDH1A1 (0.65) ALDH1A1KDM4ELMNARAB9ACYP3A4
Quinoline SCHEMBL7886400 1.00 ALDH1A1 (0.65) ALDH1A1KDM4ELMNARAB9ACYP3A4
Quinoline SCHEMBL5874264 1.00 ALDH1A1 (0.65) ALDH1A1KDM4ELMNARAB9ACYP3A4
Quinoline SCHEMBL7886403 1.00 ALDH1A1 (0.65) ALDH1A1KDM4ELMNARAB9ACYP3A4
Quinoline SCHEMBL5874270 1.00 ALDH1A1 (0.65) ALDH1A1KDM4ELMNARAB9ACYP3A4
Quinoline SCHEMBL5874253 1.00 ALDH1A1 (0.65) ALDH1A1KDM4ELMNARAB9ACYP3A4
Quinoline SCHEMBL28116721 0.93 ALDH1A1 (0.57) ALDH1A1KDM4ELMNARAB9ACYP3A4

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-7128976-B2 Composition for film formation, method of film formation, and silica-based film JSR CORPORATION (JP) 2006-10-31 US disclosed
US-20030091838-A1 Composition for film formation, method of film formation, and silica-based film JSR CORPORATION (JP) 2003-05-15 US disclosed