CHEMBL247 IC50
BioactivityChEMBL CHEMBL247 IC50 bioactivity data
3553 compounds · Target: Human immunodeficiency virus type 1 reverse transcriptase ( CHEMBL247 ↗ ) · UniProt: Q72547 ↗ · IC50
Human immunodeficiency virus type 1 reverse transcriptase, a molecular target studied in Human immunodeficiency virus 1.
| ID ↑ | SMILES | Target | Activity (nM) | Type | Ref | Link | |
|---|---|---|---|---|---|---|---|
|
1879 ↗ |
O=c1[nH]c(-c2ccc(O)cc2)nc2sc3c(c12)CCCCC3
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
3.20×103 | IC50 | CHEMBL2397398 | ChEMBL ↗ |
|
8067 ↗ |
COc1cccc2c1C(=O)c1c(O)c3c(c(O)c1C2=O)C[C@@](O)(C(C)=O)C[C@@H]3O[C@H]1C[C@H](N)[C@H](O)[C@H](C)O1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
139.00×103 | IC50 | CHEMBL178 | ChEMBL ↗ |
|
14754 ↗ |
O=c1cc(-c2ccc(O)cc2)oc2cc(O)cc(O)c12
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
443.00×103 | IC50 | CHEMBL28 | ChEMBL ↗ |
|
31149 ↗ |
O=C(O)/C(O)=C/C(=O)c1cccn1Cc1ccc(F)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
54.00×103 | IC50 | CHEMBL499273 | ChEMBL ↗ |
|
44725 ↗ |
O=C(O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1cc(O)c(O)c(O)c1)c1cc(O)c(O)c(O)c1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
730.00 | IC50 | CHEMBL297453 | ChEMBL ↗ |
|
44962 ↗ |
O=C(O[C@@H]1Cc2c(O)cc(O)cc2O[C@@H]1c1ccc(O)c(O)c1)c1cc(O)c(O)c(O)c1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
760.00 | IC50 | CHEMBL36327 | ChEMBL ↗ |
|
67712 ↗ |
Cc1cc(C#N)ccc1-c1ccnc(NCc2n[nH]c(-c3ccccc3)c2Cl)c1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
5.70 | IC50 | CHEMBL2147023 | ChEMBL ↗ |
|
69779 ↗ |
Cc1cc(C#N)cc(C)c1Oc1nc(NC2CCN(Cc3ccc(S(N)(=O)=O)cc3)CC2)nc2ccsc12
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
169.50 | IC50 | CHEMBL3929927 | ChEMBL ↗ |
|
70073 ↗ |
Cc1cc(/C=C/C#N)cc(C)c1Oc1nc(NC2CCN(Cc3ccc(S(N)(=O)=O)cc3)CC2)nc2ccsc12
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
125.50 | IC50 | CHEMBL4094163 | ChEMBL ↗ |
|
70703 ↗ |
Cc1cc(C#N)cc(C)c1Oc1nc(NC2CCN(Cc3ccc(C(N)=O)cc3)CC2)nc2c1COC2
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
51.00 | IC50 | CHEMBL4514678 | ChEMBL ↗ |
|
70732 ↗ |
Cc1cc(/C=C/C#N)cc(C)c1Oc1nc(NC2CCN(Cc3ccc(S(N)(=O)=O)cc3)CC2)nc2sccc12
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
168.20 | IC50 | CHEMBL4526732 | ChEMBL ↗ |
|
71624 ↗ |
Cc1cc(C#N)cc(C)c1Oc1nc(NC2CCN(Cc3ccc(C(N)=O)cc3)CC2)ncc1-c1ccncc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
113.00 | IC50 | CHEMBL4873054 | ChEMBL ↗ |
|
76512 ↗ |
COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)c2cc3ccc(OC)cc3oc2=O)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
370.40 | IC50 | CHEMBL4747834 | ChEMBL ↗ |
|
76514 ↗ |
CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc2ccc(O)cc2oc1=O)S(=O)(=O)c1ccc(N)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
554.40 | IC50 | CHEMBL4748014 | ChEMBL ↗ |
|
76515 ↗ |
CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)Cc1cc2ccc(O)cc2oc1=O)S(=O)(=O)c1ccc(N)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
450.80 | IC50 | CHEMBL4751162 | ChEMBL ↗ |
|
76518 ↗ |
COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)Cc2cc(=O)oc3cc(O)ccc23)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
458.60 | IC50 | CHEMBL4754375 | ChEMBL ↗ |
|
76522 ↗ |
CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc2ccccc2oc1=O)S(=O)(=O)c1ccc(N)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
75.30 | IC50 | CHEMBL4759897 | ChEMBL ↗ |
|
76526 ↗ |
COc1ccc2c(CC(=O)N[C@@H](Cc3ccccc3)[C@H](O)CN(CC(C)C)S(=O)(=O)c3ccc([N+](=O)[O-])cc3)cc(=O)oc2c1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
372.80 | IC50 | CHEMBL4762527 | ChEMBL ↗ |
|
76527 ↗ |
CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1cc2ccc(O)cc2oc1=O)S(=O)(=O)c1ccc([N+](=O)[O-])cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
188.70 | IC50 | CHEMBL4764162 | ChEMBL ↗ |
|
76530 ↗ |
COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)c2cc3ccc(O)cc3oc2=O)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
420.70 | IC50 | CHEMBL4778947 | ChEMBL ↗ |
|
76531 ↗ |
CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)Cc1cc(=O)oc2cc(O)ccc12)S(=O)(=O)c1ccc([N+](=O)[O-])cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
367.00 | IC50 | CHEMBL4779428 | ChEMBL ↗ |
|
76532 ↗ |
COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)c2ccc3oc(=O)ccc3c2)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
597.40 | IC50 | CHEMBL4779600 | ChEMBL ↗ |
|
76537 ↗ |
CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)Cc1cc(=O)oc2cc(N(C)C)ccc12)S(=O)(=O)c1ccc(N)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
572.20 | IC50 | CHEMBL4783468 | ChEMBL ↗ |
|
76539 ↗ |
COc1ccc2cc(C(=O)N[C@@H](Cc3ccccc3)[C@H](O)CN(CC(C)C)S(=O)(=O)c3ccc(N)cc3)c(=O)oc2c1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
705.70 | IC50 | CHEMBL4785073 | ChEMBL ↗ |
|
76540 ↗ |
CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)c1ccc2oc(=O)ccc2c1)S(=O)(=O)c1ccc(N)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
398.00 | IC50 | CHEMBL4785296 | ChEMBL ↗ |
|
76541 ↗ |
COc1ccc2c(CC(=O)N[C@@H](Cc3ccccc3)[C@H](O)CN(CC(C)C)S(=O)(=O)c3ccc(N)cc3)cc(=O)oc2c1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
410.60 | IC50 | CHEMBL4789192 | ChEMBL ↗ |
|
76543 ↗ |
COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)Cc2cc(=O)oc3cc(N(C)C)ccc23)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
355.10 | IC50 | CHEMBL4792023 | ChEMBL ↗ |
|
76545 ↗ |
COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)Cc2cc(=O)oc3cc(OC)ccc23)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
241.80 | IC50 | CHEMBL4796869 | ChEMBL ↗ |
|
76546 ↗ |
CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)Cc1cc2ccc(O)cc2oc1=O)S(=O)(=O)c1ccc([N+](=O)[O-])cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
375.40 | IC50 | CHEMBL4797650 | ChEMBL ↗ |
|
76548 ↗ |
COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)c2cc3ccccc3oc2=O)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
473.80 | IC50 | CHEMBL4798607 | ChEMBL ↗ |
|
76549 ↗ |
COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)/C=C/c2ccc(O)c(OC)c2)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
146.00 | IC50 | CHEMBL4845710 | ChEMBL ↗ |
|
76550 ↗ |
COc1cc(CCC(=O)N[C@@H](Cc2ccccc2)[C@H](O)CN(CC(C)C)S(=O)(=O)c2ccc(N)cc2)ccc1O
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
31.50 | IC50 | CHEMBL4847152 | ChEMBL ↗ |
|
76551 ↗ |
COc1cc(CCC(=O)N[C@@H](Cc2ccccc2)[C@H](O)CN(CC(C)C)S(=O)(=O)c2ccc(N)cc2)c(OC)cc1O
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
113.00 | IC50 | CHEMBL4848294 | ChEMBL ↗ |
|
76552 ↗ |
CCCN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)CCc1cc(OC)c(O)cc1OC)S(=O)(=O)c1ccc(OC)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
6.50 | IC50 | CHEMBL4849408 | ChEMBL ↗ |
|
76553 ↗ |
COc1ccc(S(=O)(=O)N(C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)/C=C/c2ccc(O)c(OC)c2)C2CC2)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
43.50 | IC50 | CHEMBL4850169 | ChEMBL ↗ |
|
76554 ↗ |
COc1cc(/C=C/C(=O)N[C@@H](Cc2ccccc2)[C@H](O)CN(CC(C)C)S(=O)(=O)c2ccc(SC)cc2)ccc1O
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
99.50 | IC50 | CHEMBL4851883 | ChEMBL ↗ |
|
76555 ↗ |
COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)/C=C/c2ccc(O)c(O)c2)cn1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
35.50 | IC50 | CHEMBL4852771 | ChEMBL ↗ |
|
76556 ↗ |
COc1ccc(S(=O)(=O)N(C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)CCc2cc(OC)c(O)cc2OC)C2CC2)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
9.00 | IC50 | CHEMBL4853622 | ChEMBL ↗ |
|
76557 ↗ |
COc1cc(/C=C/C(=O)N[C@@H](Cc2ccccc2)[C@H](O)CN(CC(C)C)S(=O)(=O)c2ccc(N)cc2)ccc1O
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
43.50 | IC50 | CHEMBL4853765 | ChEMBL ↗ |
|
76558 ↗ |
COc1ccc(S(=O)(=O)N(C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)CCc2cc(OC)c(O)cc2OC)C(C)C)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
299.00 | IC50 | CHEMBL4854057 | ChEMBL ↗ |
|
76559 ↗ |
CC(C)CN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)/C=C/c1ccc(O)c(O)c1)S(=O)(=O)c1ccc(N)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
7.50 | IC50 | CHEMBL4855073 | ChEMBL ↗ |
|
76560 ↗ |
COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)/C=C/c2cc(OC)c(O)c(OC)c2)cn1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
11.50 | IC50 | CHEMBL4855424 | ChEMBL ↗ |
|
76561 ↗ |
COc1ccc(S(=O)(=O)N(CC(C)C)C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)CCc2ccc(O)c(OC)c2)cn1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
241.00 | IC50 | CHEMBL4855469 | ChEMBL ↗ |
|
76562 ↗ |
COc1ccc(S(=O)(=O)N(C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)CCc2ccc(O)c(O)c2)C2CC2)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
45.50 | IC50 | CHEMBL4855701 | ChEMBL ↗ |
|
76564 ↗ |
COc1ccc(S(=O)(=O)N(C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)/C=C/c2ccc(O)c(OC)c2)C(C)C)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
87.50 | IC50 | CHEMBL4858155 | ChEMBL ↗ |
|
76565 ↗ |
COc1ccc(S(=O)(=O)N(C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)CCc2ccc(O)c(O)c2)C(C)C)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
20.50 | IC50 | CHEMBL4858568 | ChEMBL ↗ |
|
76566 ↗ |
COc1ccc(S(=O)(=O)N(C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)/C=C/c2cc(OC)c(O)c(OC)c2)C(C)C)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
199.00 | IC50 | CHEMBL4859328 | ChEMBL ↗ |
|
76567 ↗ |
COc1ccc(S(=O)(=O)N(C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)/C=C/c2ccc(O)c(O)c2)C(C)C)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
53.50 | IC50 | CHEMBL4860291 | ChEMBL ↗ |
|
76568 ↗ |
CCCN(C[C@@H](O)[C@H](Cc1ccccc1)NC(=O)CCc1ccc(O)c(O)c1)S(=O)(=O)c1ccc(OC)cc1
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
7.50 | IC50 | CHEMBL4860724 | ChEMBL ↗ |
|
76569 ↗ |
COc1cc(CCC(=O)N[C@@H](Cc2ccccc2)[C@H](O)CN(CC(C)C)S(=O)(=O)c2ccc(SC)cc2)c(OC)cc1O
|
CHEMBL247 ↗
UniProt: Q72547 ↗ |
60.70 | IC50 | CHEMBL4862102 | ChEMBL ↗ |