Other Name(s): Hsp90, HSP90
Assay:The compound was tested for binding affinity against isolated N-domain of Heat shock protein HSP 90
Type:Kd
SMILES:COC1=C2C[C@@H](C)C[C@H](OC)[C@H](O)[C@@H](C)/C=C(\C)[C@H](OC(N)=O)[C@@H](OC)/C=C\C=C(/C)C(=O)NC(=CC1=O)C2=O
Value:=775nM
Source:Fungi
Assay:The compound was tested for binding affinity against yeast Heat shock protein HSP 90
Type:Kd
SMILES:COC1=C2C[C@@H](C)C[C@H](OC)[C@H](O)[C@@H](C)/C=C(\C)[C@H](OC(N)=O)[C@@H](OC)/C=C\C=C(/C)C(=O)NC(=CC1=O)C2=O
Value:=1215nM
Source:Fungi
Assay:The compound was tested for binding affinity against isolated N-domain of Heat shock protein HSP 90
Type:Kd
SMILES:C[C@@H]1C[C@H]2O[C@@H]2/C=C\C=C\C(=O)Cc2c(Cl)c(O)cc(O)c2C(=O)O1
Value:=2.7nM
Source:Saccharomyces cerevisiae
Assay:The compound was tested for binding affinity against yeast Heat shock protein HSP 90
Type:Kd
SMILES:C[C@@H]1C[C@H]2O[C@@H]2/C=C\C=C\C(=O)Cc2c(Cl)c(O)cc(O)c2C(=O)O1
Value:=19nM
Source:Saccharomyces cerevisiae
Assay:Competitive binding towards Heat shock protein HSP 90-alpha
Type:EC50
SMILES:CO[C@H]1/C=C\C=C(/C)C(=O)NC2=CC(=O)C(NCCCCCOc3ccc4c(=O)cc(N5CCOCC5)oc4c3)=C(C[C@@H](C)C[C@H](OC)[C@H](O)[C@@H](C)/C=C(\C)[C@@H]1OC(N)=O)C2=O
Value:=2500nM
Source:
Assay:Competitive binding towards Heat shock protein HSP 90-alpha
Type:EC50
SMILES:O=c1cc(N2CCOCC2)oc2ccccc12
Value:>50000nM
Source:
Assay:Competitive binding towards Heat shock protein HSP 90-alpha
Type:EC50
SMILES:CO[C@H]1/C=C\C=C(/C)C(=O)NC2=CC(=O)C(NCCOCCOc3ccc4c(=O)cc(N5CCOCC5)oc4c3C)=C(C[C@@H](C)C[C@H](OC)[C@H](O)[C@@H](C)/C=C(\C)[C@@H]1OC(N)=O)C2=O
Value:>50000nM
Source:
Assay:Competitive binding towards Heat shock protein HSP 90-alpha
Type:EC50
SMILES:C=CCNC1=C2C[C@@H](C)C[C@H](OC)[C@H](O)[C@@H](C)/C=C(\C)[C@H](OC(N)=O)[C@@H](OC)/C=C\C=C(/C)C(=O)NC(=CC1=O)C2=O
Value:=1000nM
Source:
Assay:Competitive binding towards Heat shock protein HSP 90-alpha
Type:EC50
SMILES:CO[C@H]1/C=C\C=C(/C)C(=O)NC2=CC(=O)C(NCCCCCCOc3ccc4c(=O)cc(N5CCOCC5)oc4c3)=C(C[C@@H](C)C[C@H](OC)[C@H](O)[C@@H](C)/C=C(\C)[C@@H]1OC(N)=O)C2=O
Value:=4000nM
Source:
Assay:Competitive binding towards Heat shock protein HSP 90-alpha
Type:EC50
SMILES:CO[C@H]1/C=C\C=C(/C)C(=O)NC2=CC(=O)C(NCCCCCCCCOc3ccc4c(=O)cc(N5CCOCC5)oc4c3C)=C(C[C@@H](C)C[C@H](OC)[C@H](O)[C@@H](C)/C=C(\C)[C@@H]1OC(N)=O)C2=O
Value:=28000nM
Source:
Assay:Competitive binding towards Heat shock protein HSP 90-alpha
Type:EC50
SMILES:CO[C@H]1/C=C\C=C(/C)C(=O)NC2=CC(=O)C(NCC#Cc3cccc4c(=O)cc(N5CCOCC5)oc34)=C(C[C@@H](C)C[C@H](OC)[C@H](O)[C@@H](C)/C=C(\C)[C@@H]1OC(N)=O)C2=O
Value:=7000nM
Source:
Assay:Competitive binding towards Heat shock protein HSP 90-alpha
Type:EC50
SMILES:CO[C@H]1/C=C\C=C(/C)C(=O)NC2=CC(=O)C(NCCOCCOc3ccc4c(=O)cc(N5CCOCC5)oc4c3)=C(C[C@@H](C)C[C@H](OC)[C@H](O)[C@@H](C)/C=C(\C)[C@@H]1OC(N)=O)C2=O
Value:=16000nM
Source:
Assay:Competitive binding towards Heat shock protein HSP 90-alpha
Type:EC50
SMILES:CO[C@H]1/C=C\C=C(/C)C(=O)NC2=CC(=O)C(NCCCOc3ccc4c(=O)cc(N5CCOCC5)oc4c3)=C(C[C@@H](C)C[C@H](OC)[C@H](O)[C@@H](C)/C=C(\C)[C@@H]1OC(N)=O)C2=O
Value:=26000nM
Source:
Assay:Competitive binding towards Heat shock protein HSP 90-alpha
Type:EC50
SMILES:CO[C@H]1/C=C\C=C(/C)C(=O)NC2=CC(=O)C(NCCCCCCCOc3ccc4c(=O)cc(N5CCOCC5)oc4c3C)=C(C[C@@H](C)C[C@H](OC)[C@H](O)[C@@H](C)/C=C(\C)[C@@H]1OC(N)=O)C2=O
Value:=46000nM
Source:
Assay:Competitive binding towards Heat shock protein HSP 90-alpha
Type:EC50
SMILES:COC[C@H]1OC(=O)c2coc3c2[C@@]1(C)C1=C(C3=O)C2CCC(=O)[C@@]2(C)C[C@H]1C(=O)OC
Value:>50000nM
Source:
Assay:Competitive binding towards Heat shock protein HSP 90-alpha
Type:EC50
SMILES:CO[C@H]1/C=C\C=C(/C)C(=O)NC2=CC(=O)C(NCCCCOc3ccc4c(=O)cc(N5CCOCC5)oc4c3)=C(C[C@@H](C)C[C@H](OC)[C@H](O)[C@@H](C)/C=C(\C)[C@@H]1OC(N)=O)C2=O
Value:=10000nM
Source:
Assay:Competitive binding towards Heat shock protein HSP 90-alpha
Type:EC50
SMILES:CO[C@H]1/C=C\C=C(/C)C(=O)NC2=CC(=O)C(NCCCC#Cc3cccc4c(=O)cc(N5CCOCC5)oc34)=C(C[C@@H](C)C[C@H](OC)[C@H](O)[C@@H](C)/C=C(\C)[C@@H]1OC(N)=O)C2=O
Value:>50000nM
Source:
Assay:In vitro dissociation constant for heat shock 90 kDa protein alpha
Type:Kd
SMILES:CCc1cc(-c2n[nH]c(C(=O)O)c2-c2ccc3c(c2)OCO3)c(O)cc1O
Value:=680nM
Source:
Assay:In vitro dissociation constant for heat shock 90 kDa protein alpha
Type:Kd
SMILES:CCc1cc(-c2n[nH]cc2-c2c[nH]cn2)c(O)cc1O
Value:=280nM
Source:
Assay:Effective concentration of compound against heat shock protein HSP90 determined in normal lung cells
Type:EC50
SMILES:C#CCCCn1c(Sc2cc(OC)ccc2OC)nc2c(N)ncnc21
Value:>75000nM
Source:Homo sapiens

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