BDBM54552 1-[4-(2,5-dimethylphenyl)-1-piperazinyl]-3-[3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]-1-propanone::1-[4-(2,5-dimethylphenyl)piperazin-1-yl]-3-[3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]propan-1-one::1-[4-(2,5-dimethylphenyl)piperazino]-3-[3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]propan-1-one::KUC103363N::UNM-0000306073::cid_42596901
SMILES: Cc1ccc(C)c(c1)N1CCN(CC1)C(=O)CCc1nc(no1)-c1ccc(cc1)C(F)(F)F
InChI Key: InChIKey=UIBQZXPXJUWVIV-UHFFFAOYSA-N
Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Ras-related C3 botulinum toxin substrate 1 (Mus musculus) | BDBM54552 (1-[4-(2,5-dimethylphenyl)-1-piperazinyl]-3-[3-[4-(...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | 180 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2PC30TH | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Ras-related C3 botulinum toxin substrate 1 (Mus musculus) | BDBM54552 (1-[4-(2,5-dimethylphenyl)-1-piperazinyl]-3-[3-[4-(...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | 200 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2JS9NV0 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
cell division cycle 42 (GTP binding protein, 25kDa) (Homo sapiens (Human)) | BDBM54552 (1-[4-(2,5-dimethylphenyl)-1-piperazinyl]-3-[3-[4-(...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | 680 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2HT2MQ5 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
cell division cycle 42 (GTP binding protein, 25kDa) (Homo sapiens (Human)) | BDBM54552 (1-[4-(2,5-dimethylphenyl)-1-piperazinyl]-3-[3-[4-(...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | 770 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q20000HB | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
cell division cycle 42 (GTP binding protein, 25kDa) (Homo sapiens (Human)) | BDBM54552 (1-[4-(2,5-dimethylphenyl)-1-piperazinyl]-3-[3-[4-(...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 4.98E+3 | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q23B5XM4 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Ras-related C3 botulinum toxin substrate 1 (Mus musculus) | BDBM54552 (1-[4-(2,5-dimethylphenyl)-1-piperazinyl]-3-[3-[4-(...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 1.95E+3 | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2T43RHD | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Ras-related protein Rab-2A. (Canis lupus familiaris) | BDBM54552 (1-[4-(2,5-dimethylphenyl)-1-piperazinyl]-3-[3-[4-(...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 3.00E+4 | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q25H7DQC | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
cell division cycle 42 (GTP binding protein, 25kDa) (Homo sapiens (Human)) | BDBM54552 (1-[4-(2,5-dimethylphenyl)-1-piperazinyl]-3-[3-[4-(...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 3.21E+3 | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2NK3CFW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
ras protein (Homo sapiens (Human)) | BDBM54552 (1-[4-(2,5-dimethylphenyl)-1-piperazinyl]-3-[3-[4-(...) | GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 3.00E+4 | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2C53J83 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Ras-related C3 botulinum toxin substrate 1 (Mus musculus) | BDBM54552 (1-[4-(2,5-dimethylphenyl)-1-piperazinyl]-3-[3-[4-(...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 2.19E+3 | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2PK0DK8 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
ras protein (Homo sapiens (Human)) | BDBM54552 (1-[4-(2,5-dimethylphenyl)-1-piperazinyl]-3-[3-[4-(...) | GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 3.00E+4 | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2JQ0ZF7 | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
GTP-binding protein (rab7) (Canis lupus familiaris) | BDBM54552 (1-[4-(2,5-dimethylphenyl)-1-piperazinyl]-3-[3-[4-(...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet | PC cid PC sid UniChem Similars | PCBioAssay | n/a | n/a | n/a | n/a | 3.00E+4 | n/a | n/a | n/a | n/a |
NMMLSC Curated by PubChem BioAssay | Assay Description University of New Mexico Assay Overview: Assay Support: NIH I RO3 MH081231-01 HTS to identify specific small molecule inhibitors of Ras and Ras-rela... | PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2F18X40 | |||||||||||
More data for this Ligand-Target Pair |