Benzotriazole

Benzotriazole

SCHEMBL28276294

O=C(O)O.O=C(O)O.O=C(O)O.c1ccc2[nH]nnc2c1.c1ccc2[nH]nnc2c1.c1ccc2[nH]nnc2c1.c1ccc2[nH]nnc2c1

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GSK3AGSK3BIMPA1

The experimentally established mechanism targets of Benzotriazole. 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
L3MBTL1 Q9Y468 1/20 0.39
SMN1; SMN2 Q16637 3/20 0.39
MAPT P10636 2/20 0.39
ALDH1A1 P00352 2/20 0.39
CHRM1 P11229 1/20 0.39
HPGD P15428 4/20 0.38
KDM4E B2RXH2 3/20 0.38
KMT2A Q03164 3/20 0.38
RAB9A P51151 2/20 0.38
NPC1 O15118 1/20 0.38
PKM P14618 1/20 0.38
MAOB P27338 1/20 0.38
ADORA2A P29274 1/20 0.38
HTT P42858 1/20 0.38
DAO P14920 1/20 0.37
SRD5A2 P31213 1/20 0.37
HSD17B10 Q99714 1/20 0.37
MGAM O43451 1/20 0.37
F2 P00734 1/20 0.37
AMY1A P0DUB6 1/20 0.37

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
Benzotriazole SCHEMBL39112 1.00 L3MBTL1 (0.39) L3MBTL1SMN1; SMN2MAPTALDH1A1CHRM1
Benzotriazole SCHEMBL4948842 1.00 L3MBTL1 (0.39) L3MBTL1SMN1; SMN2MAPTALDH1A1CHRM1
Benzotriazole SCHEMBL28276295 1.00 L3MBTL1 (0.39) L3MBTL1SMN1; SMN2MAPTALDH1A1CHRM1
Benzotriazole SCHEMBL28212495 0.94 NPC1 (0.38) L3MBTL1SMN1; SMN2ALDH1A1CHRM1HPGD
Benzotriazole SCHEMBL9019467 0.93 TDP1 (0.39) L3MBTL1SMN1; SMN2MAPTALDH1A1CHRM1
Benzotriazole SCHEMBL21629494 0.92 CHRM1 (0.37) SMN1; SMN2MAPTALDH1A1CHRM1HPGD
Benzotriazole SCHEMBL27661352 0.92 CHRM1 (0.37) SMN1; SMN2MAPTALDH1A1CHRM1HPGD
Benzotriazole SCHEMBL1507756 0.92 CHRM1 (0.37) SMN1; SMN2MAPTALDH1A1CHRM1HPGD
Benzotriazole SCHEMBL2458393 0.92 CYP3A4 (0.41) L3MBTL1SMN1; SMN2MAPTALDH1A1CHRM1
Benzotriazole SCHEMBL27976494 0.92 LMNA (0.41) SMN1; SMN2MAPTALDH1A1CHRM1HPGD

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-105037523-B Interferon mutant and its polyethyleneglycol derivative 北京三元基因药业股份有限公司 2019-02-19 CN disclosed