CHEMBL3729 Ki

Bioactivity

ChEMBL CHEMBL3729 Ki bioactivity data

1008 compounds · Target: Carbonic anhydrase 4 ( CHEMBL3729 ↗ ) · UniProt: P22748 ↗ · Ki

Carbonic anhydrase 4, a molecular target studied in Homo sapiens.

Chemical Space
–
ID ↑ SMILES Target Activity (nM) Type Ref Link
6570 ↗
O=c1oc2c(O)c(O)cc3c(=O)oc4c(O)c(O)cc1c4c23
CHEMBL3729 ↗
UniProt: P22748 ↗ 		9.08×103 Ki CHEMBL6246 ChEMBL ↗
6574 ↗
Cc1ccc(NC(=O)c2ccc(CN3CCN(C)CC3)cc2)cc1Nc1nccc(-c2cccnc2)n1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		4.55×103 Ki CHEMBL941 ChEMBL ↗
6753 ↗
CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O
CHEMBL3729 ↗
UniProt: P22748 ↗ 		6.51×103 Ki CHEMBL325041 ChEMBL ↗
11601 ↗
Nc1ccc(S(N)(=O)=O)cc1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		9.76×103 Ki CHEMBL21 ChEMBL ↗
11815 ↗
O=C1NS(=O)(=O)c2ccccc21
CHEMBL3729 ↗
UniProt: P22748 ↗ 		7.92×103 Ki CHEMBL310671 ChEMBL ↗
13340 ↗
O=c1c(O)c(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
CHEMBL3729 ↗
UniProt: P22748 ↗ 		7.89×103 Ki CHEMBL50 ChEMBL ↗
14315 ↗
Oc1ccc(/C=C/c2cc(O)cc(O)c2)cc1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		4.47×103 Ki CHEMBL165 ChEMBL ↗
14767 ↗
O=c1c(O)c(-c2ccccc2)oc2cc(O)cc(O)c12
CHEMBL3729 ↗
UniProt: P22748 ↗ 		568.30 Ki CHEMBL309490 ChEMBL ↗
16141 ↗
O=C1C[C@@H](c2ccc(O)cc2)Oc2cc(O)cc(O)c21
CHEMBL3729 ↗
UniProt: P22748 ↗ 		79.50 Ki CHEMBL9352 ChEMBL ↗
17678 ↗
O=c1cc(-c2ccc(O)c(O)c2)oc2cc(O)cc(O)c12
CHEMBL3729 ↗
UniProt: P22748 ↗ 		293.00 Ki CHEMBL151 ChEMBL ↗
17957 ↗
Cc1cn(-c2cc(NC(=O)c3ccc(C)c(Nc4nccc(-c5cccnc5)n4)c3)cc(C(F)(F)F)c2)cn1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		446.00 Ki CHEMBL255863 ChEMBL ↗
19961 ↗
NS(=O)(=O)Oc1ccc2c3c(c(=O)oc2c1)CCCCC3
CHEMBL3729 ↗
UniProt: P22748 ↗ 		24.00 Ki CHEMBL286738 ChEMBL ↗
20840 ↗
COc1cc(/C=C/C(=O)/C=C(O)/C=C/c2ccc(O)c(OC)c2)ccc1O
CHEMBL3729 ↗
UniProt: P22748 ↗ 		4.97×103 Ki CHEMBL116438 ChEMBL ↗
20908 ↗
O=C(O)/C=C/c1ccc(O)c(O)c1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		10.10×103 Ki CHEMBL145 ChEMBL ↗
24164 ↗
O=c1ccc2ccc(OCc3ccccc3)cc2o1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		5.80×103 Ki CHEMBL145781 ChEMBL ↗
25674 ↗
CCOC(=O)c1cc2ccc(OC)cc2oc1=O
CHEMBL3729 ↗
UniProt: P22748 ↗ 		7.20×103 Ki CHEMBL568385 ChEMBL ↗
25679 ↗
Cc1ccc2oc(=O)c(C(=O)O)cc2c1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		8.50×103 Ki CHEMBL577123 ChEMBL ↗
25717 ↗
O=C(O)c1cc2ccccc2oc1=O
CHEMBL3729 ↗
UniProt: P22748 ↗ 		9.70×103 Ki CHEMBL83294 ChEMBL ↗
26746 ↗
NS(=O)(=O)c1cc2c(cc1Cl)NC(C(Cl)Cl)NS2(=O)=O
CHEMBL3729 ↗
UniProt: P22748 ↗ 		449.00 Ki CHEMBL1054 ChEMBL ↗
26747 ↗
NS(=O)(=O)c1cc(C2(O)NC(=O)c3ccccc32)ccc1Cl
CHEMBL3729 ↗
UniProt: P22748 ↗ 		196.00 Ki CHEMBL1055 ChEMBL ↗
26819 ↗
CC(=O)Nc1ccc(O)cc1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		11.40×103 Ki CHEMBL112 ChEMBL ↗
26820 ↗
Nc1ccc(O)cc1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		743.00×103 Ki CHEMBL1142 ChEMBL ↗
26854 ↗
O=c1cc(-c2ccccc2)oc2cc(O)cc(O)c12
CHEMBL3729 ↗
UniProt: P22748 ↗ 		537.75 Ki CHEMBL117 ChEMBL ↗
26855 ↗
COc1ccc(C(=O)O)cc1OC
CHEMBL3729 ↗
UniProt: P22748 ↗ 		6.48×103 Ki CHEMBL118903 ChEMBL ↗
26860 ↗
NS(=O)(=O)c1nnc(NC(=O)C23CC4CC(CC(C4)C2)C3)s1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		349.00 Ki CHEMBL1209038 ChEMBL ↗
26861 ↗
NS(=O)(=O)c1nnc(NC(=O)CC23CC4CC(CC(C4)C2)C3)s1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		413.00 Ki CHEMBL1209039 ChEMBL ↗
26862 ↗
CC(C)(C)OC(=O)N(CCCCN(CCCNC(=O)C(F)(F)F)C(=O)OC(C)(C)C)CCCNC(=O)C(F)(F)F
CHEMBL3729 ↗
UniProt: P22748 ↗ 		104.00×103 Ki CHEMBL1212954 ChEMBL ↗
26863 ↗
NCCNCCCNCCN
CHEMBL3729 ↗
UniProt: P22748 ↗ 		44.00×103 Ki CHEMBL1214193 ChEMBL ↗
26864 ↗
CN(C)CCN(C)CCN(C)CCN(C)C
CHEMBL3729 ↗
UniProt: P22748 ↗ 		53.00 Ki CHEMBL1214194 ChEMBL ↗
26865 ↗
NCCNc1cccc2ccccc12
CHEMBL3729 ↗
UniProt: P22748 ↗ 		58.00 Ki CHEMBL1214195 ChEMBL ↗
26866 ↗
O=C(NCCCNCCCCNCCCNC(=O)C(F)(F)F)C(F)(F)F
CHEMBL3729 ↗
UniProt: P22748 ↗ 		116.00 Ki CHEMBL1214248 ChEMBL ↗
26867 ↗
O=C(NCCNCCCNCCNC(=O)C(F)(F)F)C(F)(F)F
CHEMBL3729 ↗
UniProt: P22748 ↗ 		108.00×103 Ki CHEMBL1214249 ChEMBL ↗
26868 ↗
CC(=O)NCCNc1cccc2ccccc12
CHEMBL3729 ↗
UniProt: P22748 ↗ 		12.30×103 Ki CHEMBL1214323 ChEMBL ↗
26872 ↗
CP(=O)(O)O
CHEMBL3729 ↗
UniProt: P22748 ↗ 		310.00×103 Ki CHEMBL122938 ChEMBL ↗
26896 ↗
COc1ccc2c(C(=O)O)cc(=O)oc2c1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		26.80×103 Ki CHEMBL12567 ChEMBL ↗
26932 ↗
CCC(=O)Nc1nnc(S(N)(=O)=O)s1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		780.00×10-3 Ki CHEMBL1288786 ChEMBL ↗
26933 ↗
CCCC(=O)Nc1nnc(S(N)(=O)=O)s1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		370.00×10-3 Ki CHEMBL1288787 ChEMBL ↗
26934 ↗
CC(C)C(=O)Nc1nnc(S(N)(=O)=O)s1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		440.00×10-3 Ki CHEMBL1288807 ChEMBL ↗
26947 ↗
Oc1ccccc1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		9.50×103 Ki CHEMBL14060 ChEMBL ↗
26950 ↗
COc1cc(C(=O)O)cc(OC)c1O
CHEMBL3729 ↗
UniProt: P22748 ↗ 		10.60×103 Ki CHEMBL1414 ChEMBL ↗
26973 ↗
CCCCCCCCCCOS(N)(=O)=O
CHEMBL3729 ↗
UniProt: P22748 ↗ 		67.60 Ki CHEMBL153094 ChEMBL ↗
26981 ↗
NS(=O)(=O)c1ccc(N/C=C/C(=O)c2ccc(Br)cc2)cc1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		6.50 Ki CHEMBL1582269 ChEMBL ↗
26983 ↗
c1ccc2[nH]ccc2c1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		2.33×103 Ki CHEMBL15844 ChEMBL ↗
27016 ↗
COc1ccccc1OC
CHEMBL3729 ↗
UniProt: P22748 ↗ 		14.32×103 Ki CHEMBL1668603 ChEMBL ↗
27045 ↗
NS(=O)(=O)OCCCCCCCCCCOS(N)(=O)=O
CHEMBL3729 ↗
UniProt: P22748 ↗ 		91.20 Ki CHEMBL171476 ChEMBL ↗
27049 ↗
NS(=O)(=O)c1nnc(NS(=O)(=O)c2cccc(C(=O)OCCCCO[N+](=O)[O-])c2)s1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		154.00 Ki CHEMBL1738778 ChEMBL ↗
27073 ↗
NS(=O)(=O)c1ccc(OCCCO[N+](=O)[O-])cc1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		148.00 Ki CHEMBL1777820 ChEMBL ↗
27074 ↗
NS(=O)(=O)c1ccc(C(=O)OCCCCO[N+](=O)[O-])cc1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		44.00 Ki CHEMBL1778431 ChEMBL ↗
27075 ↗
NS(=O)(=O)c1ccc(C(=O)OCc2ccc(CO[N+](=O)[O-])cc2)cc1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		345.00 Ki CHEMBL1778432 ChEMBL ↗
27076 ↗
COc1cc(/C=C/C(=O)OCCCCO[N+](=O)[O-])ccc1OC(=O)c1ccc(S(N)(=O)=O)cc1
CHEMBL3729 ↗
UniProt: P22748 ↗ 		47.00 Ki CHEMBL1778433 ChEMBL ↗