Terephthalic Acid

Terephthalic Acid

SCHEMBL9717815

Nc1ccc(C(=O)O)cc1.O=C(O)c1ccc(C(=O)O)cc1

nearest known ligand 0.71

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

OPRM1

The experimentally established mechanism targets of Terephthalic Acid. 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
TSHR P16473 3/20 0.71
TP53 P04637 1/20 0.71
SRD5A2 P31213 3/20 0.60
CA1 P00915 4/20 0.57
CA2 P00918 4/20 0.57
CA12 O43570 3/20 0.57
CA9 Q16790 3/20 0.57
CA3 P07451 2/20 0.57
CA6 P23280 2/20 0.57
CA5A P35218 2/20 0.57
CA7 P43166 2/20 0.57
CA14 Q9ULX7 2/20 0.57
CA5B Q9Y2D0 2/20 0.57
TYR P14679 1/20 0.57
DRD1 P21728 1/20 0.57
CA4 P22748 1/20 0.57
DAO P14920 1/20 0.55
NAPRT Q6XQN6 1/20 0.55
ALOX15 P16050 1/20 0.55
TPMT P51580 1/20 0.55

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
Aminobenzoic Acid SCHEMBL1768920 1.00 TSHR (0.71) TSHRTP53SRD5A2CA1CA2
Aminobenzoic Acid SCHEMBL8249 1.00 TSHR (0.71) TSHRTP53SRD5A2CA1CA2
Terephthalic Acid SCHEMBL7648718 1.00 TSHR (0.71) TSHRTP53SRD5A2CA1CA2
Aminobenzoic Acid SCHEMBL10995559 0.97 TSHR (0.67) TSHRTP53SRD5A2CA1CA2
Aminobenzoic Acid SCHEMBL25326411 0.97 TSHR (0.67) TSHRTP53SRD5A2CA1CA2
Aminobenzoic Acid SCHEMBL23121593 0.97 TSHR (0.67) TSHRTP53SRD5A2CA1CA2
Aminobenzoic Acid SCHEMBL9317391 0.97 TSHR (0.67) TSHRTP53SRD5A2CA1CA2
Aminobenzoic Acid SCHEMBL20549750 0.97 TSHR (0.67) TSHRTP53SRD5A2CA1CA2
Aminobenzoic Acid SCHEMBL2519368 0.97 TSHR (0.67) TSHRTP53SRD5A2CA1CA2
Aminobenzoic Acid SCHEMBL25354995 0.97 TSHR (0.67) TSHRTP53SRD5A2CA1CA2

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-5094777-A Fluorescent dye DAY GLO COLOR CORPORATION (US) 1992-03-10 US disclosed