CHEMBL226 Ki
BioactivityChEMBL CHEMBL226 Ki bioactivity data
3722 compounds · Target: Adenosine receptor A1 ( CHEMBL226 ↗ ) · UniProt: P30542 ↗ · Ki
Adenosine receptor A1, a molecular target studied in Homo sapiens.
| ID ↑ | SMILES | Target | Activity (nM) | Type | Ref | Link | |
|---|---|---|---|---|---|---|---|
|
7728 ↗ |
Nc1ccccc1NC(=O)c1ccc(CCn2ncc3c2nc(N)n2nc(-c4ccco4)nc32)cc1
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
71.20 | Ki | CHEMBL5076343 | ChEMBL ↗ |
|
7878 ↗ |
Nc1nc(-c2ccco2)c2cnn(CCc3ccc(C(=O)Nc4ccccc4N)cc3)c2n1
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
503.30 | Ki | CHEMBL5199428 | ChEMBL ↗ |
|
7883 ↗ |
Nc1nc(-c2ccco2)c2cnn(Cc3cccc(OCCCCCCC(=O)NO)c3)c2n1
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
105.60 | Ki | CHEMBL5201523 | ChEMBL ↗ |
|
14300 ↗ |
COc1cccc(COC(=O)c2nn(-c3ccccc3)nc2N)c1
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
220.00 | Ki | CHEMBL1561896 | ChEMBL ↗ |
|
23509 ↗ |
Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
812.83 | Ki | CHEMBL477 | ChEMBL ↗ |
|
24387 ↗ |
O=C(CCc1ccccc1)Nc1nc2ccccc2c(=O)s1
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
1.05×103 | Ki | CHEMBL2380385 | ChEMBL ↗ |
|
24388 ↗ |
COc1cccc(CCC(=O)Nc2nc3ccccc3c(=O)s2)c1
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
1.37×103 | Ki | CHEMBL2380386 | ChEMBL ↗ |
|
24389 ↗ |
Cc1ccc2nc(NC(=O)CCCc3ccccc3)sc(=O)c2c1
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
1.00×103 | Ki | CHEMBL2382420 | ChEMBL ↗ |
|
24390 ↗ |
O=C(CCCc1ccccc1)Nc1nc2cc(Cl)ccc2c(=O)s1
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
785.00 | Ki | CHEMBL2382423 | ChEMBL ↗ |
|
24392 ↗ |
O=C(CCCc1ccccc1)Nc1nc2sccc2c(=O)s1
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
364.00 | Ki | CHEMBL2382425 | ChEMBL ↗ |
|
24400 ↗ |
O=C(CCCc1ccccc1)Nc1nc2ccccc2c(=O)s1
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
2.50×103 | Ki | CHEMBL2382434 | ChEMBL ↗ |
|
24401 ↗ |
COc1cccc(CCCC(=O)Nc2nc3ccccc3c(=O)s2)c1
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
214.00 | Ki | CHEMBL2382435 | ChEMBL ↗ |
|
24403 ↗ |
O=C(C/C=C/c1ccccc1)Nc1nc2ccccc2c(=O)s1
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
822.00 | Ki | CHEMBL2382438 | ChEMBL ↗ |
|
24404 ↗ |
COc1cccc(/C=C/CC(=O)Nc2nc3ccccc3c(=O)s2)c1
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
500.00 | Ki | CHEMBL2382439 | ChEMBL ↗ |
|
24477 ↗ |
CCn1c(=O)c2c(nc3n2CCCN3CCc2ccccc2OC)n(CC)c1=O
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
3.92×103 | Ki | CHEMBL3093225 | ChEMBL ↗ |
|
24480 ↗ |
CCn1c(=O)c2c(nc3n2CCCN3C2CCCCC2)n(CC)c1=O
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
1.04×103 | Ki | CHEMBL3093230 | ChEMBL ↗ |
|
24482 ↗ |
Cn1c(=O)c2c(nc3n2CCCN3c2ccc(Cl)cc2)n(C)c1=O
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
10.00×103 | Ki | CHEMBL3093233 | ChEMBL ↗ |
|
24485 ↗ |
Cn1c(=O)c2c(nc3n2CCCN3Cc2cc(Cl)cc(Cl)c2)n(C)c1=O
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
1.70×103 | Ki | CHEMBL3093237 | ChEMBL ↗ |
|
24490 ↗ |
C#CCn1c(=O)c2c(nc3n2CCCN3Cc2ccccc2)n(C)c1=O
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
249.00 | Ki | CHEMBL3093310 | ChEMBL ↗ |
|
24491 ↗ |
C#CCn1c(=O)c2c(nc3n2CCCN3Cc2ccccc2OC)n(C)c1=O
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
605.00 | Ki | CHEMBL3093311 | ChEMBL ↗ |
|
24492 ↗ |
C#CCn1c(=O)c2c(nc3n2CCCN3Cc2cccc(OC)c2)n(C)c1=O
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
1.33×103 | Ki | CHEMBL3093312 | ChEMBL ↗ |
|
24493 ↗ |
C#CCn1c(=O)c2c(nc3n2CCCN3Cc2ccc(OC)cc2)n(C)c1=O
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
10.20×103 | Ki | CHEMBL3093313 | ChEMBL ↗ |
|
24494 ↗ |
C#CCn1c(=O)c2c(nc3n2CCCN3Cc2cccs2)n(C)c1=O
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
410.00 | Ki | CHEMBL3093315 | ChEMBL ↗ |
|
24495 ↗ |
CCn1c(=O)c2c(nc3n2CCCN3c2ccc(F)cc2)n(CC)c1=O
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
6.65×103 | Ki | CHEMBL3093325 | ChEMBL ↗ |
|
24873 ↗ |
COc1ccc2oc(=O)c(C(=O)Nc3cccc(O)c3)cc2c1
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
41.00×103 | Ki | CHEMBL4081648 | ChEMBL ↗ |
|
24939 ↗ |
O=C(Nc1nc2cccc(Cl)c2[nH]1)c1ccccc1
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
1.00×103 | Ki | CHEMBL4128848 | ChEMBL ↗ |
|
25153 ↗ |
Cn1c(=O)c2c(nc3n2CCN([C@@H]2CCCc4ccccc42)C3)n(C)c1=O
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
393.00 | Ki | CHEMBL4451303 | ChEMBL ↗ |
|
25221 ↗ |
Cn1c(=O)c2c(nc3n2CCN(CCc2ccc(Cl)cc2Cl)C3)n(C)c1=O
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
3.52×103 | Ki | CHEMBL4474238 | ChEMBL ↗ |
|
25295 ↗ |
Cn1c(=O)c2c(nc3n2CCN(Cc2ccc(Cl)c(Cl)c2)C3)n(C)c1=O
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
791.00 | Ki | CHEMBL4548500 | ChEMBL ↗ |
|
25296 ↗ |
Cn1c(=O)c2c(nc3n2CCN(Cc2csc(-c4ccc(C(F)(F)F)cc4)n2)C3)n(C)c1=O
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
236.00 | Ki | CHEMBL4549506 | ChEMBL ↗ |
|
25308 ↗ |
Cn1c(=O)c2c(nc3n2CCN(Cc2csc(-c4ccc(Cl)cc4)n2)C3)n(C)c1=O
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
492.00 | Ki | CHEMBL4554778 | ChEMBL ↗ |
|
25316 ↗ |
Cn1c(=O)c2c(nc3n2CCN(CCc2ccc(Cl)cc2C(F)(F)F)C3)n(C)c1=O
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
553.00 | Ki | CHEMBL4556578 | ChEMBL ↗ |
|
25366 ↗ |
Cn1c(=O)c2c(nc3n2CCCCN3Cc2cccc(Br)c2)n(C)c1=O
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
651.00 | Ki | CHEMBL4579508 | ChEMBL ↗ |
|
29335 ↗ |
Nc1nc(-c2cccc(O)c2)cn2c(=O)n(-c3ccccc3)nc12
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
14.00 | Ki | CHEMBL4068548 | ChEMBL ↗ |
|
30641 ↗ |
Nc1nc(-c2ccc(S(N)(=O)=O)cc2)cn2c(=O)n(-c3ccccc3)nc12
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
205.00 | Ki | CHEMBL4741273 | ChEMBL ↗ |
|
30652 ↗ |
Nc1nc(-c2ccc(NC(=O)c3ccc(O)c(O)c3)cc2)cn2c(=O)n(-c3ccccc3)nc12
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
545.70 | Ki | CHEMBL4745014 | ChEMBL ↗ |
|
30687 ↗ |
Nc1nc(-c2ccc(NC(=O)CCNC(=O)c3cccc(S(N)(=O)=O)c3)cc2)cn2c(=O)n(-c3ccccc3)nc12
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
418.00 | Ki | CHEMBL4753875 | ChEMBL ↗ |
|
30696 ↗ |
Nc1nc(-c2ccc(NC(=O)c3ccc(C(=O)NO)cc3)cc2)cn2c(=O)n(-c3ccccc3)nc12
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
395.00 | Ki | CHEMBL4755619 | ChEMBL ↗ |
|
30709 ↗ |
Nc1nc(-c2ccc(OCCNCCc3ccc(S(N)(=O)=O)cc3)cc2)cn2c(=O)n(-c3ccccc3)nc12
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
283.20 | Ki | CHEMBL4757832 | ChEMBL ↗ |
|
30713 ↗ |
CN(C)c1nc(-c2ccc(S(N)(=O)=O)cc2)cn2c(=O)n(-c3ccccc3)nc12
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
435.30 | Ki | CHEMBL4758605 | ChEMBL ↗ |
|
30734 ↗ |
Nc1nc(-c2ccc(NC(=O)CCNC(=O)c3ccc(S(N)(=O)=O)cc3)cc2)cn2c(=O)n(-c3ccccc3)nc12
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
1.07×103 | Ki | CHEMBL4761976 | ChEMBL ↗ |
|
30744 ↗ |
Nc1nc(-c2ccc(NC(=O)c3cccc(S(N)(=O)=O)c3)cc2)cn2c(=O)n(-c3ccccc3)nc12
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
1.21×103 | Ki | CHEMBL4764597 | ChEMBL ↗ |
|
30745 ↗ |
Nc1nc(-c2ccc(NCc3ccc(S(N)(=O)=O)cc3)cc2)cn2c(=O)n(-c3ccccc3)nc12
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
87.70 | Ki | CHEMBL4764804 | ChEMBL ↗ |
|
30750 ↗ |
Nc1nc(-c2ccc(NCC(=O)c3ccc(S(N)(=O)=O)cc3)cc2)cn2c(=O)n(-c3ccccc3)nc12
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
131.00 | Ki | CHEMBL4777796 | ChEMBL ↗ |
|
30787 ↗ |
Nc1nc(-c2ccc(OCCNC(=O)c3ccc(S(N)(=O)=O)cc3)cc2)cn2c(=O)n(-c3ccccc3)nc12
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
420.40 | Ki | CHEMBL4786281 | ChEMBL ↗ |
|
30818 ↗ |
Nc1nc(-c2ccc(NC(=O)CCNCCc3ccc(S(N)(=O)=O)cc3)cc2)cn2c(=O)n(-c3ccccc3)nc12
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
1.03×103 | Ki | CHEMBL4793920 | ChEMBL ↗ |
|
30835 ↗ |
Nc1nc(-c2ccc(NC(=O)c3ccc(S(N)(=O)=O)cc3)cc2)cn2c(=O)n(-c3ccccc3)nc12
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
4.19×103 | Ki | CHEMBL4797036 | ChEMBL ↗ |
|
30838 ↗ |
Nc1nc(-c2ccc(NC(=O)CCNCc3ccc(S(N)(=O)=O)cc3)cc2)cn2c(=O)n(-c3ccccc3)nc12
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
839.00 | Ki | CHEMBL4797465 | ChEMBL ↗ |
|
30849 ↗ |
Nc1nc(-c2ccc(NC(=O)c3ccc(O)cc3)cc2)cn2c(=O)n(-c3ccccc3)nc12
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
194.00 | Ki | CHEMBL4799118 | ChEMBL ↗ |
|
37609 ↗ |
N#Cc1c(-c2cccs2)cc(-c2cccs2)nc1N
|
CHEMBL226 ↗
UniProt: P30542 ↗ |
43.00 | Ki | CHEMBL455264 | ChEMBL ↗ |