Ethyl Nicotinate

Ethyl Nicotinate

SCHEMBL30545166

CC(C)N.CCOC(=O)c1cccnc1

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.62
ALDH1A1 P00352 8/20 0.60
MAPT P10636 4/20 0.60
KMT2A Q03164 7/20 0.59
LMNA P02545 4/20 0.59
TDP1 Q9NUW8 2/20 0.56
TP53 P04637 1/20 0.55
MEN1 O00255 3/20 0.55
HPGD P15428 2/20 0.54
KDM4E B2RXH2 2/20 0.54
CYP1A2 P05177 1/20 0.53
CYP2C9 P11712 1/20 0.53
TSHR P16473 1/20 0.53
CYP2C19 P33261 1/20 0.53

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
Ethyl Nicotinate SCHEMBL8164637 0.92 L3MBTL1 (0.71) L3MBTL1ALDH1A1MAPTKMT2ALMNA
Ethyl Nicotinate SCHEMBL24853 0.92 L3MBTL1 (0.71) L3MBTL1ALDH1A1MAPTKMT2ALMNA
Ethyl Nicotinate SCHEMBL1330922 0.92 L3MBTL1 (0.71) L3MBTL1ALDH1A1MAPTKMT2ALMNA
Ethyl Nicotinate SCHEMBL29958752 0.92 L3MBTL1 (0.71) L3MBTL1ALDH1A1MAPTKMT2ALMNA
Ethyl Nicotinate SCHEMBL8071110 0.91 L3MBTL1 (0.69) L3MBTL1ALDH1A1MAPTKMT2ALMNA
Ethyl Nicotinate SCHEMBL30525807 0.91 L3MBTL1 (0.69) L3MBTL1ALDH1A1MAPTKMT2ALMNA
Ethyl Nicotinate SCHEMBL11484012 0.91 L3MBTL1 (0.69) L3MBTL1ALDH1A1MAPTKMT2ALMNA
Ethyl Nicotinate SCHEMBL9408506 0.91 L3MBTL1 (0.69) L3MBTL1ALDH1A1MAPTKMT2ALMNA
Ethyl Nicotinate SCHEMBL29234036 0.91 L3MBTL1 (0.69) L3MBTL1ALDH1A1MAPTKMT2ALMNA
Ethyl Nicotinate SCHEMBL27665006 0.91 L3MBTL1 (0.69) L3MBTL1ALDH1A1MAPTKMT2ALMNA

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-116669722-A Interleukin-1 receptor-related kinase (IRAK) degradants and uses thereof 凯麦拉医疗公司 2023-08-29 CN disclosed