Assay Detail
Binding
CHEMBL4014684
Review assay metadata, readout intent, target linkage, and publication context from the same page.
Inhibition of recombinant HIV-1 group M subtype B RT-RNase H activity expressed in Escherichia coli M15 using 18-nucleotide 3'-fluorescein-labeled RNA annealed to a complementary 18-nucleotide 5'-dabsyl-labeled DNA as substrate measured after 1 hr
31
Total Activities
31
Compounds Tested
1
Activity Types
0
Assay Parameters
Assay Information
| Assay Type | Binding |
| Organism | HIV-1 group M |
| Confidence | 0 — Uncurated / Unknown |
| Curated By | Autocuration |
Publication
Natural product-inspired esters and amides of ferulic and caffeic acid as dual inhibitors of HIV-1 reverse transcriptase.
Activity Statistics
| Type | Count | Avg pChEMBL | Best pChEMBL |
|---|---|---|---|
| IC50 | 31 | 4.88 | 6.17 |
Compounds Tested
| Compound | Name | Phase | Activities | Best pChEMBL |
|---|---|---|---|---|
| CHEMBL4096993 | — | — | 1 | 6.17 |
| CHEMBL4072951 | — | — | 1 | 5.98 |
| CHEMBL4093652 | — | — | 1 | 5.97 |
| CHEMBL169 | URSOLIC ACID | 2.0 | 1 | 5.26 |
| CHEMBL168 | OLEANOLIC_ACID | — | 1 | 5.12 |
| CHEMBL4071001 | — | — | 1 | 5.08 |
| CHEMBL486986 | POMOLIC ACID | — | 1 | 5.03 |
| CHEMBL4076949 | — | — | 1 | 5.00 |
| CHEMBL4102151 | — | — | 1 | 4.97 |
| CHEMBL4083395 | — | — | 1 | 4.93 |
| CHEMBL1669147 | — | — | 1 | 4.92 |
| CHEMBL269277 | BETULINIC ACID | 1.0 | 1 | 4.88 |
| CHEMBL4101379 | — | — | 1 | 4.81 |
| CHEMBL4092175 | — | — | 1 | 4.77 |
| CHEMBL4068271 | — | — | 1 | 4.64 |
| CHEMBL4060370 | — | — | 1 | 4.62 |
| CHEMBL4102295 | — | — | 1 | 4.60 |
| CHEMBL1669148 | — | — | 1 | 4.57 |
| CHEMBL4078035 | — | — | 1 | 4.43 |
| CHEMBL478589 | GERANYLGERANIOL | — | 1 | 4.41 |
| CHEMBL2105350 | OLEYL ALCOHOL | -1.0 | 1 | 4.40 |
| CHEMBL4064372 | — | — | 1 | 4.24 |
| CHEMBL4085909 | — | — | 1 | 4.12 |
| CHEMBL4062364 | — | — | 1 | 4.08 |
| CHEMBL442022 | — | — | 1 | - |
| CHEMBL286796 | ETHYL FERULATE | — | 1 | - |
| CHEMBL13883 | VANILLIN | -1.0 | 1 | - |
| CHEMBL400247 | STIGMASTEROL | — | 1 | - |
| CHEMBL32749 | FERULATE | -1.0 | 1 | - |
| CHEMBL223228 | EFAVIRENZ | 4.0 | 1 | - |
Activity Data
| Compound | Name | Type | Rel. | Value | Units | pChEMBL |
|---|---|---|---|---|---|---|
| CHEMBL4096993 | — | IC50 | = | 680.0 | nM | 6.17 |
| CHEMBL4072951 | — | IC50 | = | 1040.0 | nM | 5.98 |
| CHEMBL4093652 | — | IC50 | = | 1060.0 | nM | 5.97 |
| CHEMBL169 | URSOLIC ACID | IC50 | = | 5500.0 | nM | 5.26 |
| CHEMBL168 | OLEANOLIC_ACID | IC50 | = | 7500.0 | nM | 5.12 |
| CHEMBL4071001 | — | IC50 | = | 8400.0 | nM | 5.08 |
| CHEMBL486986 | POMOLIC ACID | IC50 | = | 9300.0 | nM | 5.03 |
| CHEMBL4076949 | — | IC50 | = | 10100.0 | nM | 5.00 |
| CHEMBL4102151 | — | IC50 | = | 10600.0 | nM | 4.97 |
| CHEMBL4083395 | — | IC50 | = | 11700.0 | nM | 4.93 |
| CHEMBL1669147 | — | IC50 | = | 12100.0 | nM | 4.92 |
| CHEMBL269277 | BETULINIC ACID | IC50 | = | 13200.0 | nM | 4.88 |
| CHEMBL4101379 | — | IC50 | = | 15600.0 | nM | 4.81 |
| CHEMBL4092175 | — | IC50 | = | 17000.0 | nM | 4.77 |
| CHEMBL4068271 | — | IC50 | = | 22800.0 | nM | 4.64 |
| CHEMBL4060370 | — | IC50 | = | 23900.0 | nM | 4.62 |
| CHEMBL4102295 | — | IC50 | = | 25300.0 | nM | 4.60 |
| CHEMBL1669148 | — | IC50 | = | 26900.0 | nM | 4.57 |
| CHEMBL4078035 | — | IC50 | = | 37300.0 | nM | 4.43 |
| CHEMBL478589 | GERANYLGERANIOL | IC50 | = | 39000.0 | nM | 4.41 |
| CHEMBL2105350 | OLEYL ALCOHOL | IC50 | = | 40000.0 | nM | 4.40 |
| CHEMBL4064372 | — | IC50 | = | 57300.0 | nM | 4.24 |
| CHEMBL4085909 | — | IC50 | = | 75000.0 | nM | 4.12 |
| CHEMBL4062364 | — | IC50 | = | 84000.0 | nM | 4.08 |
| CHEMBL442022 | — | IC50 | > | 100000.0 | nM | - |
| CHEMBL286796 | ETHYL FERULATE | IC50 | > | 100000.0 | nM | - |
| CHEMBL13883 | VANILLIN | IC50 | > | 100000.0 | nM | - |
| CHEMBL400247 | STIGMASTEROL | IC50 | = | 158300.0 | nM | - |
| CHEMBL32749 | FERULATE | IC50 | > | 100000.0 | nM | - |
| CHEMBL223228 | EFAVIRENZ | IC50 | - | — | - | |
| CHEMBL242529 | CONIFERYL ALDEHYDE | IC50 | > | 100000.0 | nM | - |