Assay Detail
Binding
CHEMBL747158
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Binding affinity against Neurokinin 1(NK1) receptor from human IM-9 cells using [I]-Bolton Hunter labeled SP
19
Total Activities
19
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Cell Type | IM-9 |
| Confidence | 8 — Homologous single protein target |
| Curated By | Expert |
Publication
Identification and chemical synthesis of MDL 105,212, a non-peptide tachykinin antagonist with high affinity for NK1 and NK2 receptors
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 19 | 7.19 | 9.48 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL16192 | CP-96345 | — | 1 | 9.48 |
| CHEMBL330366 | — | — | 1 | 8.51 |
| CHEMBL82386 | — | — | 1 | 8.21 |
| CHEMBL368159 | — | — | 1 | 7.64 |
| CHEMBL172915 | — | — | 1 | 7.32 |
| CHEMBL367528 | — | — | 1 | 7.19 |
| CHEMBL172676 | — | — | 1 | 7.18 |
| CHEMBL369174 | — | — | 1 | 7.18 |
| CHEMBL176769 | — | — | 1 | 7.16 |
| CHEMBL176682 | — | — | 1 | 7.13 |
| CHEMBL173245 | — | — | 1 | 6.97 |
| CHEMBL173420 | — | — | 1 | 6.90 |
| CHEMBL369498 | — | — | 1 | 6.86 |
| CHEMBL176951 | — | — | 1 | 6.78 |
| CHEMBL176860 | — | — | 1 | 6.60 |
| CHEMBL362394 | — | — | 1 | 6.57 |
| CHEMBL176811 | — | — | 1 | 6.50 |
| CHEMBL308148 | SAREDUTANT | 3.0 | 1 | 6.23 |
| CHEMBL444086 | — | — | 1 | 6.20 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL16192 | CP-96345 | IC50 | = | 0.33 | nM | 9.48 |
| CHEMBL330366 | — | IC50 | = | 3.11 | nM | 8.51 |
| CHEMBL82386 | — | IC50 | = | 6.19 | nM | 8.21 |
| CHEMBL368159 | — | IC50 | = | 22.8 | nM | 7.64 |
| CHEMBL172915 | — | IC50 | = | 48.2 | nM | 7.32 |
| CHEMBL367528 | — | IC50 | = | 64.1 | nM | 7.19 |
| CHEMBL172676 | — | IC50 | = | 66.2 | nM | 7.18 |
| CHEMBL369174 | — | IC50 | = | 65.9 | nM | 7.18 |
| CHEMBL176769 | — | IC50 | = | 69.9 | nM | 7.16 |
| CHEMBL176682 | — | IC50 | = | 73.6 | nM | 7.13 |
| CHEMBL173245 | — | IC50 | = | 107.0 | nM | 6.97 |
| CHEMBL173420 | — | IC50 | = | 127.0 | nM | 6.90 |
| CHEMBL369498 | — | IC50 | = | 138.0 | nM | 6.86 |
| CHEMBL176951 | — | IC50 | = | 168.0 | nM | 6.78 |
| CHEMBL176860 | — | IC50 | = | 252.0 | nM | 6.60 |
| CHEMBL362394 | — | IC50 | = | 271.0 | nM | 6.57 |
| CHEMBL176811 | — | IC50 | = | 313.0 | nM | 6.50 |
| CHEMBL308148 | SAREDUTANT | IC50 | = | 593.0 | nM | 6.23 |
| CHEMBL444086 | — | IC50 | = | 634.0 | nM | 6.20 |