Balsalazide

Balsalazide

SCHEMBL17392780

Nc1ccc(O)c(C(=O)O)c1.O=C(O)CCNC(=O)c1ccc(/N=N/c2ccc(O)c(C(=O)O)c2)cc1.O=C(O)c1cc(/N=N/c2ccc(O)c(C(=O)O)c2)ccc1O

nearest known ligand 0.87

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
PTGS2 known ✓ P35354 2/20 0.49
PTGS1 known ✓ P23219 1/20 0.48
SIRT5 Q9NXA8 5/20 0.87
TDP1 Q9NUW8 5/20 0.87
NME4 O00746 3/20 0.87
GCDH Q92947 3/20 0.87
ADORA3 P0DMS8 1/20 0.87
CHRM1 P11229 1/20 0.87
ADORA2A P29274 1/20 0.87
AVPR2 P30518 1/20 0.87
AGTR1 P30556 1/20 0.87
SLC6A4 P31645 1/20 0.87
AVPR1A P37288 1/20 0.87
HTR3A P46098 1/20 0.87
SLC29A1 Q99808 1/20 0.87
HRH3 Q9Y5N1 1/20 0.87
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
KDR P35968 2/20 0.51
PDE4A P27815 1/20 0.51

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 SCHEMBL20184744 1.00 SIRT5 (0.87) SIRT5TDP1NME4GCDHADORA3
Balsalazide SCHEMBL3267109 0.93 SIRT5 (1.00) SIRT5TDP1NME4GCDHADORA3
Balsalazide SCHEMBL29377041 0.93 SIRT5 (1.00) SIRT5TDP1NME4GCDHADORA3
Balsalazide SCHEMBL118300 0.93 SIRT5 (1.00) SIRT5TDP1NME4GCDHADORA3
Balsalazide SCHEMBL138311 0.93 SIRT5 (1.00) SIRT5TDP1NME4GCDHADORA3
Balsalazide SCHEMBL7908058 0.92 SIRT5 (0.97) SIRT5TDP1NME4GCDHADORA3
Balsalazide SCHEMBL5598491 0.92 SIRT5 (0.97) SIRT5TDP1NME4GCDHADORA3
Balsalazide SCHEMBL134019 0.92 SIRT5 (0.97) SIRT5TDP1NME4GCDHADORA3
Balsalazide SCHEMBL28818120 0.92 SIRT5 (0.97) SIRT5TDP1NME4GCDHADORA3
Balsalazide SCHEMBL133200 0.91 SIRT5 (0.95) SIRT5TDP1NME4GCDHADORA3

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
US-20160002343-A1 BLOOD-BRAIN BARRIER (BBB) PENETRATING DUAL SPECIFIC BINDING PROTEINS FOR TREATING BRAIN AND NEUROLOGICAL DISEASES ABBVIE INC. 2016-01-07 US claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160002343-A1 BLOOD-BRAIN BARRIER (BBB) PENETRATING DUAL SPECIFIC BINDING PROTEINS FOR TREATING BRAIN AND NEUROLOGICAL DISEASES FABP7, DCX, VCAM1 PTGS2 2781/4885PTGS1 3346/4885SIRT5 3612/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.