Assay Detail
ADMET
CHEMBL3381606
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Cytotoxicity against human MRC5 SV2 cells assessed as reduction in cell growth after 72 hrs
76
Total Activities
76
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | ADMET |
| Organism | Homo sapiens |
| Cell Type | MRC5 |
| Confidence | 0 — Uncurated / Unknown |
| Curated By | Autocuration |
Publication
From human immunodeficiency virus non-nucleoside reverse transcriptase inhibitors to potent and selective antitrypanosomal compounds.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 76 | 5.04 | 6.28 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL3338018 | — | — | 1 | 6.28 |
| CHEMBL3338027 | — | — | 1 | 5.99 |
| CHEMBL3338032 | — | — | 1 | 5.68 |
| CHEMBL3338030 | — | — | 1 | 5.67 |
| CHEMBL69503 | — | — | 1 | 5.55 |
| CHEMBL3338035 | — | — | 1 | 5.36 |
| CHEMBL71659 | — | — | 1 | 5.28 |
| CHEMBL3338034 | — | — | 1 | 5.25 |
| CHEMBL3338009 | — | — | 1 | 5.25 |
| CHEMBL3338013 | — | — | 1 | 5.23 |
| CHEMBL3338043 | — | — | 1 | 5.20 |
| CHEMBL3338025 | — | — | 1 | 5.17 |
| CHEMBL3338038 | — | — | 1 | 5.13 |
| CHEMBL71521 | — | — | 1 | 5.13 |
| CHEMBL166 | MELARSOPROL | 3.0 | 1 | 5.13 |
| CHEMBL302791 | — | — | 1 | 5.12 |
| CHEMBL3338023 | — | — | 1 | 5.12 |
| CHEMBL3338048 | — | — | 1 | 5.10 |
| CHEMBL3338040 | — | — | 1 | 5.09 |
| CHEMBL3338041 | — | — | 1 | 5.05 |
| CHEMBL3338044 | — | — | 1 | 5.00 |
| CHEMBL578061 | — | — | 1 | 4.88 |
| CHEMBL470025 | — | — | 1 | 4.78 |
| CHEMBL3338045 | — | — | 1 | 4.76 |
| CHEMBL74174 | — | — | 1 | 4.69 |
| CHEMBL3338031 | — | — | 1 | 4.64 |
| CHEMBL3338026 | — | — | 1 | 4.63 |
| CHEMBL3338047 | — | — | 1 | 4.59 |
| CHEMBL223228 | EFAVIRENZ | 4.0 | 1 | 4.59 |
| CHEMBL3338054 | — | — | 1 | 4.59 |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL3338018 | — | IC50 | = | 520.0 | nM | 6.28 |
| CHEMBL3338027 | — | IC50 | = | 1030.0 | nM | 5.99 |
| CHEMBL3338032 | — | IC50 | = | 2110.0 | nM | 5.68 |
| CHEMBL3338030 | — | IC50 | = | 2120.0 | nM | 5.67 |
| CHEMBL69503 | — | IC50 | = | 2820.0 | nM | 5.55 |
| CHEMBL3338035 | — | IC50 | = | 4380.0 | nM | 5.36 |
| CHEMBL71659 | — | IC50 | = | 5250.0 | nM | 5.28 |
| CHEMBL3338034 | — | IC50 | = | 5640.0 | nM | 5.25 |
| CHEMBL3338009 | — | IC50 | = | 5580.0 | nM | 5.25 |
| CHEMBL3338013 | — | IC50 | = | 5840.0 | nM | 5.23 |
| CHEMBL3338043 | — | IC50 | = | 6360.0 | nM | 5.20 |
| CHEMBL3338025 | — | IC50 | = | 6740.0 | nM | 5.17 |
| CHEMBL166 | MELARSOPROL | IC50 | = | 7400.0 | nM | 5.13 |
| CHEMBL71521 | — | IC50 | = | 7480.0 | nM | 5.13 |
| CHEMBL3338038 | — | IC50 | = | 7320.0 | nM | 5.13 |
| CHEMBL302791 | — | IC50 | = | 7630.0 | nM | 5.12 |
| CHEMBL3338023 | — | IC50 | = | 7510.0 | nM | 5.12 |
| CHEMBL3338048 | — | IC50 | = | 8010.0 | nM | 5.10 |
| CHEMBL3338040 | — | IC50 | = | 8170.0 | nM | 5.09 |
| CHEMBL3338041 | — | IC50 | = | 8920.0 | nM | 5.05 |
| CHEMBL3338044 | — | IC50 | = | 10000.0 | nM | 5.00 |
| CHEMBL578061 | — | IC50 | = | 13200.0 | nM | 4.88 |
| CHEMBL470025 | — | IC50 | = | 16610.0 | nM | 4.78 |
| CHEMBL3338045 | — | IC50 | = | 17410.0 | nM | 4.76 |
| CHEMBL74174 | — | IC50 | = | 20510.0 | nM | 4.69 |
| CHEMBL3338031 | — | IC50 | = | 22920.0 | nM | 4.64 |
| CHEMBL3338026 | — | IC50 | = | 23570.0 | nM | 4.63 |
| CHEMBL3338047 | — | IC50 | = | 25500.0 | nM | 4.59 |
| CHEMBL223228 | EFAVIRENZ | IC50 | = | 25840.0 | nM | 4.59 |
| CHEMBL3338054 | — | IC50 | = | 25920.0 | nM | 4.59 |
| CHEMBL3338024 | — | IC50 | = | 33940.0 | nM | 4.47 |
| CHEMBL3338052 | — | IC50 | = | 34050.0 | nM | 4.47 |
| CHEMBL72529 | — | IC50 | = | 43070.0 | nM | 4.37 |
| CHEMBL3338028 | — | IC50 | = | 53500.0 | nM | 4.27 |
| CHEMBL3337998 | — | IC50 | > | 64000.0 | nM | - |
| CHEMBL3338010 | — | IC50 | > | 32000.0 | nM | - |
| CHEMBL3338055 | — | IC50 | > | 64000.0 | nM | - |
| CHEMBL3338049 | — | IC50 | > | 64000.0 | nM | - |
| CHEMBL3338050 | — | IC50 | > | 64000.0 | nM | - |
| CHEMBL3338042 | — | IC50 | > | 64000.0 | nM | - |
| CHEMBL421114 | — | IC50 | > | 64000.0 | nM | - |
| CHEMBL3338051 | — | IC50 | > | 64000.0 | nM | - |
| CHEMBL3338053 | — | IC50 | > | 64000.0 | nM | - |
| CHEMBL57 | NEVIRAPINE | IC50 | > | 64000.0 | nM | - |
| CHEMBL593 | DELAVIRDINE | IC50 | > | 64000.0 | nM | - |
| CHEMBL308954 | ETRAVIRINE | IC50 | > | 64000.0 | nM | - |
| CHEMBL54893 | UC 781 | IC50 | > | 64000.0 | nM | - |
| CHEMBL3338039 | — | IC50 | > | 64000.0 | nM | - |
| CHEMBL3338046 | — | IC50 | > | 64000.0 | nM | - |
| CHEMBL70663 | DAPIVIRINE | IC50 | > | 64000.0 | nM | - |