Compound Detail
CHEMBL3989951
NAVOXIMOD 🧪 Phase II
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🧪 Phase II
Basic Information
| ChEMBL ID | CHEMBL3989951 |
| Name | NAVOXIMOD |
| Phase | Phase II |
| Structure Type | MOL |
| InChI Key | YGACXVRLDHEXKY-WXRXAMBDSA-N |
5
Targets
31
Activities
3
Assay Types
30
PK Parameters
20
Publications
10
Known Names
1
Indications
Molecular Properties
316.4
MW (Da)
2.89
ALogP
4
HBA
2
HBD
58.3
PSA (Ų)
0.92
QED
0
Ro5 Violations
3
Rot. Bonds
Drug Information
| Molecule Type | Small molecule |
| Chirality | Single Enantiomer |
Indications
Neoplasms
Activity Summary
IC50 21 meas. best 7.89
EC50 7 meas. best 7.12
Ki 3 meas. best 8.24
Target Activity Profile
| Target | Type | Best pChEMBL | Mean pChEMBL | Best (nM) | # Data |
|---|---|---|---|---|---|
| Indoleamine 2,3-dioxygenase 1 CHEMBL4685 | Ki | 8.24 | 7.8367 | 5.8 | 3 |
| Indoleamine 2,3-dioxygenase 1 CHEMBL4685 | IC50 | 7.89 | 7.1842 | 13.0 | 12 |
| Indoleamine 2,3-dioxygenase 1 CHEMBL4685 | EC50 | 7.12 | 7.08 | 75.0 | 3 |
| Tryptophan 2,3-dioxygenase CHEMBL2140 | IC50 | 6.85 | 6.44 | 140.0 | 5 |
| Tryptophan 2,3-dioxygenase CHEMBL2140 | EC50 | 5.82 | 5.68 | 1510.0 | 3 |
| Cytochrome P450 3A4 CHEMBL340 | IC50 | 5.55 | 5.2033 | 2800.0 | 3 |
| Voltage-gated inwardly rectifying potassium channel KCNH2 CHEMBL240 | EC50 | 4.15 | 4.15 | 71000.0 | 1 |
| Cytochrome P450 2D6 CHEMBL289 | IC50 | 4.07 | 4.07 | 86000.0 | 1 |
Pharmacokinetic Data
| Parameter | Value | Units | Species |
|---|---|---|---|
| AUC | 3930.0 | ng.hr.mL-1 | Rattus norvegicus |
| AUC | 13400.0 | ng.hr.mL-1 | Rattus norvegicus |
| AUC | 34950.0 | ng.hr.mL-1 | Rattus norvegicus |
| AUC | 1630.0 | ng.hr.mL-1 | Rattus norvegicus |
| AUC | 7975.0 | ng.hr.mL-1 | Rattus norvegicus |
| AUC | 15400.0 | ng.hr.mL-1 | Rattus norvegicus |
| AUC | 6132.0 | ng.hr.mL-1 | Mus musculus |
| AUC | 34633.0 | ng.hr.mL-1 | Mus musculus |
| AUC | 3777.0 | ng.hr.mL-1 | Mus musculus |
| AUC | 60195.0 | ng.hr.mL-1 | Mus musculus |
| AUC | 282.0 | ng.hr.mL-1 | Canis lupus familiaris |
| AUC | 901.0 | ng.hr.mL-1 | Canis lupus familiaris |
| AUC | 3127.0 | ng.hr.mL-1 | Canis lupus familiaris |
| AUC | 10050.0 | ng.hr.mL-1 | Canis lupus familiaris |
| AUC | 207.0 | ng.hr.mL-1 | Canis lupus familiaris |
| AUC | 1045.0 | ng.hr.mL-1 | Canis lupus familiaris |
| AUC | 8645.0 | ng.hr.mL-1 | Canis lupus familiaris |
| AUC | 57750.0 | ng.hr.mL-1 | Canis lupus familiaris |
| AUC | 22500.0 | ng.hr.mL-1 | Rattus norvegicus |
| AUC | 22550.0 | ng.hr.mL-1 | Canis lupus familiaris |
| CL | 8.52 | mL.min-1.kg-1 | Homo sapiens |
| CL | 44.6 | mL.min-1.kg-1 | Rattus norvegicus |
| CL | 32.0 | mL.min-1.kg-1 | Rattus norvegicus |
| CL | 23.2 | mL.min-1.kg-1 | Rattus norvegicus |
| CL | 27.5 | mL.min-1.kg-1 | Mus musculus |
| CL | 25.0 | mL.min-1.kg-1 | Mus musculus |
| CL | 59.3 | mL.min-1.kg-1 | Canis lupus familiaris |
| CL | 56.1 | mL.min-1.kg-1 | Canis lupus familiaris |
| CL | 53.7 | mL.min-1.kg-1 | Canis lupus familiaris |
| CL | 41.4 | mL.min-1.kg-1 | Canis lupus familiaris |
Activity Data Samples
Top measurements by pChEMBL value
Literature References
Data from ChEMBL 36 via Core Engine