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Compound Detail

CHEMBL302795

TENOXICAM
🧪 Phase II
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🧪 Phase II
CN1C(C(=O)Nc2ccccn2)=C(O)c2sccc2S1(=O)=O

Basic Information

ChEMBL ID CHEMBL302795
Name TENOXICAM
Phase Phase II
Structure Type MOL
InChI Key LZNWYQJJBLGYLT-UHFFFAOYSA-N
Therapeutic ✓ Yes

Known Names

Mobiflex NSC-758397 RO 12-0068 RO 12-0068/000 RO-12-0068/000 RO-120068000 Tenoxicam Tilcotil
2
Targets
2
Activities
1
Assay Types
10
PK Parameters
20
Publications
8
Known Names
2
Indications

Molecular Properties

337.4
MW (Da)
1.64
ALogP
6
HBA
2
HBD
99.6
PSA (Ų)
0.87
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral

Flags

Natural Product
USAN Stem -icam
USAN Year 1987

Extended Properties

Molecular Formula C13H11N3O4S2
MW 337.38
Aromatic Rings 2
Heavy Atoms 22
NP-Likeness -1.39

Indications

Rheumatic Diseases Pain

ATC Classification

M01AC02
tenoxicam
Level 1: MUSCULO-SKELETAL SYSTEM
Level 2: ANTIINFLAMMATORY AND ANTIRHEUMATIC PRODUCTS

Activity Summary

IC50 2 meas. best 5.94

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Prostaglandin G/H synthase 1
CHEMBL221
IC50 5.94 5.94 1140.0 1
Unchecked
CHEMBL612545
IC50 4.3 4.3 49500.0 1

Pharmacokinetic Data

Parameter Value Units Species
CL 0.073 mL.min-1.kg-1 Homo sapiens
CL 0.03 mL.min-1.kg-1 Homo sapiens
CL 0.0297 mL.min-1.kg-1 Homo sapiens
CL 0.03 mL.min-1.kg-1 Homo sapiens
CL 0.03 mL.min-1.kg-1 Homo sapiens
F 80.0 % Homo sapiens
Fu 0.0085 - Homo sapiens
Fu 0.0085 - Homo sapiens
MRT 92.0 hr Homo sapiens
T1/2 67.0 hr Homo sapiens

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Prostaglandin G/H synthase 1 IC50 = 1140.0 nM 5.94 DRUGMATRIX: Cyclooxygenase COX-1 enzyme inhibition (substrate: Arachidonic acid) -
Unchecked IC50 = 49500.0 nM 4.3 Inhibition of soybean 15-LOX 37862815

Literature References

PubMed DOI Target Context # Activities
- 10.5281/zenodo.13943903 ADMET 89
31158845 10.1038/s41586-019-1291-3 ADMET 55
15646539 10.1016/s0399-8320(04)95062-2 Unchecked 11
15646539 10.1016/s0399-8320(04)95062-2 NON-PROTEIN TARGET 8
20070106 10.1021/jm901371v Homo sapiens 8
18426954 10.1124/dmd.108.020479 ADMET 4
31995375 10.1021/acs.jmedchem.0c00046 Albumin 4
20869876 10.1016/j.bmc.2010.08.052 Albumin 4
38747896 10.1021/acs.jmedchem.4c00596 No relevant target 4
20014752 10.1021/tx900326k Hepatotoxicity 3
37468498 10.1038/s41467-023-40064-9 Cannabinoid receptor 1 3
3494124 10.1021/jm00387a017 Rattus norvegicus 3
- 10.6019/CHEMBL4808148 Histone deacetylase 6 3
19445515 10.1021/jm900403j Homo sapiens 2
23378628 10.1124/dmd.112.050054 ADMET 2
37468498 10.1038/s41467-023-40064-9 Mu-type opioid receptor 2
- 10.6019/CHEMBL4651402 SARS-CoV-2 2
15267234 10.1021/jm040760a No relevant target 2
10891117 10.1021/jm0000564 ADMET 2
10891117 10.1021/jm0000564 No relevant target 2

Data from ChEMBL 36 via Core Engine