Quinoxaline

Quinoxaline

SCHEMBL27596038

CO.c1ccc2nccnc2c1

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.50
KDM4E B2RXH2 4/20 0.43
POLB P06746 2/20 0.43
LMNA P02545 2/20 0.43
P4HTM Q9NXG6 2/20 0.43
CYP1A2 P05177 1/20 0.43
CCR1 P32246 1/20 0.43
CCR5 P51681 1/20 0.43
CCR8 P51685 1/20 0.43
METAP1 P53582 1/20 0.43
BLM P54132 1/20 0.43
HIF1A Q16665 1/20 0.43
DOHH Q9BU89 1/20 0.43
NCF1 P14598 1/20 0.42
MAPT P10636 3/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
USP2 O75604 1/20 0.41
L3MBTL1 Q9Y468 2/20 0.40
CES2 O00748 1/20 0.40

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
Quinoxaline SCHEMBL27549902 0.90 ALDH1A1 (0.52) ALDH1A1KDM4EPOLBLMNAP4HTM
Quinoxaline SCHEMBL5315 0.90 ALDH1A1 (0.58) ALDH1A1KDM4EPOLBLMNAP4HTM
Quinoxaline SCHEMBL29355228 0.90 ALDH1A1 (0.58) ALDH1A1KDM4EPOLBLMNAP4HTM
Quinoxaline SCHEMBL6928518 0.90 ALDH1A1 (0.58) ALDH1A1KDM4EPOLBLMNAP4HTM
Quinoxaline SCHEMBL30320908 0.90 ALDH1A1 (0.58) ALDH1A1KDM4EPOLBLMNAP4HTM
Quinoxaline SCHEMBL27924506 0.88 ALDH1A1 (0.50) ALDH1A1KDM4EPOLBLMNAP4HTM
Quinoxaline SCHEMBL4292166 0.88 ALDH1A1 (0.50) ALDH1A1KDM4EPOLBLMNAP4HTM
Quinoxaline SCHEMBL5358841 0.87 ALDH1A1 (0.55) ALDH1A1KDM4EPOLBLMNAP4HTM
Quinoxaline SCHEMBL4000710 0.87 ALDH1A1 (0.55) ALDH1A1KDM4EPOLBLMNAP4HTM
Quinoxaline SCHEMBL19877228 0.87 ALDH1A1 (0.55) ALDH1A1KDM4EPOLBLMNAP4HTM

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
CN-1609105-A 1-hydroxymethyl imidazo [1, 2-alpha ] quinoxaline compound and application thereof INST OF TOXIC PHARMACOLOGY ACA (CN) 2005-04-27 CN claimed
CN-100386326-C 1-hydroxymethyl imidazo [1, 2-a ] quinoxaline compound and application thereof INST OF TOXIC PHARMACOLOGY ACA (CN) 2008-05-07 CN disclosed
CN-1609105-A 1-hydroxymethyl imidazo [1, 2-alpha ] quinoxaline compound and application thereof INST OF TOXIC PHARMACOLOGY ACA (CN) 2005-04-27 CN disclosed