Target Binding Site Detail
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T54093 | Target Info | |||
| Target Name | T-box transcription factor T (TBXT) | ||||
| Synonyms | T; Protein T | ||||
| Target Type | Clinical trial Target | ||||
| Gene Name | T | ||||
| UniProt ID | |||||
| Ligand General Information | Top | ||||
|---|---|---|---|---|---|
| Ligand Name | [4-(Cyclopropanecarbonyl)piperazin-1-yl](furan-2-yl)methanone | Ligand Info | |||
| Canonical SMILES | C1CC1C(=O)N2CCN(CC2)C(=O)C3=CC=CO3 | ||||
| InChI | 1S/C13H16N2O3/c16-12(10-3-4-10)14-5-7-15(8-6-14)13(17)11-2-1-9-18-11/h1-2,9-10H,3-8H2 | ||||
| InChIKey | SMBREKYBPARCFW-UHFFFAOYSA-N | ||||
| PubChem Compound ID | 1203008 | ||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| PDB ID: 5QS7 PanDDA analysis group deposition -- Crystal Structure of human Brachyury G177D variant in complex with Z32327641 | ||||||
| Method | X-ray diffraction | Resolution | 1.66 Å | Mutation | Yes | [1] |
| PDB Sequence |
ELRVGLEESE
50 LWLRFKELTN60 EMIVTKNGRR70 MFPVLKVNVS80 GLDPNAMYSF90 LLDFVAADNH 100 RWKYVNGEWV110 PGGKPEPQAP120 SCVYIHPDSP130 NFGAHWMKAP140 VSFSKVKLTN 150 KLNGGGQIML160 NSLHKYEPRI170 HIVRVGDPQR180 MITSHCFPET190 QFIAVTAYQN 200 EEITALKIKY210 N
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| PDB ID: 5QRH PanDDA analysis group deposition -- Crystal Structure of human Brachyury in complex with Z32327641 | ||||||
| Method | X-ray diffraction | Resolution | 1.81 Å | Mutation | No | [2] |
| PDB Sequence |
ELRVGLEESE
50 LWLRFKELTN60 EMIVTKNGRR70 MFPVLKVNVS80 GLDPNAMYSF90 LLDFVAADNH 100 RWKYVNGEWV110 PGGKPEPQAP120 SCVYIHPDSP130 NFGAHWMKAP140 VSFSKVKLTN 150 KLNGGGQIML160 NSLHKYEPRI170 HIVRVGGPQR180 MITSHCFPET190 QFIAVTAYQN 200 EEITALKIKY210 N
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| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | PanDDA analysis group deposition | ||||
| REF 2 | PanDDA analysis group deposition | ||||
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