Balsalazide

Balsalazide

SCHEMBL28818120

O=C(O)CCNC(=O)c1ccc(N=Nc2ccc(O)c(C(=O)O)c2)cc1.[NaH].[NaH]

nearest known ligand 0.97

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ALOX5PPARGPTGS1PTGS2

The experimentally established mechanism targets of Balsalazide. 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
PTGS1 known ✓ P23219 1/20 0.50
PTGS2 known ✓ P35354 1/20 0.50
SIRT5 Q9NXA8 5/20 0.97
NME4 O00746 3/20 0.97
GCDH Q92947 3/20 0.97
TDP1 Q9NUW8 3/20 0.97
HRH3 Q9Y5N1 2/20 0.97
ADORA3 P0DMS8 1/20 0.97
CHRM1 P11229 1/20 0.97
ADORA2A P29274 1/20 0.97
AVPR2 P30518 1/20 0.97
AGTR1 P30556 1/20 0.97
SLC6A4 P31645 1/20 0.97
AVPR1A P37288 1/20 0.97
HTR3A P46098 1/20 0.97
SLC29A1 Q99808 1/20 0.97
MEN1 O00255 3/20 0.57
KMT2A Q03164 3/20 0.57
BLVRB P30043 2/20 0.57
PDE4A P27815 1/20 0.57

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
Balsalazide SCHEMBL7908058 1.00 SIRT5 (0.97) SIRT5NME4GCDHTDP1HRH3
Balsalazide SCHEMBL134019 1.00 SIRT5 (0.97) SIRT5NME4GCDHTDP1HRH3
Balsalazide SCHEMBL133200 0.99 SIRT5 (0.95) SIRT5NME4GCDHTDP1HRH3
Balsalazide SCHEMBL29377041 0.99 SIRT5 (1.00) SIRT5NME4GCDHTDP1HRH3
Balsalazide SCHEMBL3267109 0.99 SIRT5 (1.00) SIRT5NME4GCDHTDP1HRH3
Balsalazide SCHEMBL118300 0.99 SIRT5 (1.00) SIRT5NME4GCDHTDP1HRH3
Balsalazide SCHEMBL138311 0.99 SIRT5 (1.00) SIRT5NME4GCDHTDP1HRH3
Balsalazide SCHEMBL5598491 0.97 SIRT5 (0.97) SIRT5NME4GCDHTDP1HRH3
Balsalazide SCHEMBL20184744 0.92 SIRT5 (0.87) SIRT5NME4GCDHTDP1HRH3
Balsalazide SCHEMBL17392780 0.92 SIRT5 (0.87) SIRT5NME4GCDHTDP1HRH3

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
CN-113970607-B Detection method of related substances in balsalazide sodium capsules 马应龙药业集团股份有限公司 2024-03-26 CN disclosed
CN-113970607-A Method for detecting related substances in balsalazide disodium capsule 马应龙药业集团股份有限公司 2022-01-25 CN disclosed