Attributes
UniProt ID
Protein Name
Tumor necrosis factor
Ligand Name
~{N}4-(phenylmethyl)-~{N}4-[2-[3-(2-piperazin-1-ylpyrimidin-5-yl)phenyl]phenyl]pyrimidine-2,4-diamine
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
FRBABIFCTILEGV-UHFFFAOYSA-N
SMILES
c1ccc(cc1)CN(c2ccccc2c3cccc(c3)c4cnc(nc4)N5CCNCC5)c6ccnc(n6)N
Drug Action
No data available
Affinity Metrics
No affinity data available
3D Structure
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Structure: 5MU8
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Color Legend
Unassigned regionsLigand / hetero atomse5mu8A1e5mu8B1e5mu8C1e5mu8D1e5mu8F1e5mu8G1e5mu8H1e5mu8I1e5mu8J1e5mu8K1e5mu8L1e5mu8M1e5mu8N1e5mu8O1e5mu8P1e5mu8Q1e5mu8R1e5mu8S1e5mu8T1e5mu8U1e5mu8V1e5mu8W1e5mu8X1e5mu8Y1e5mu8Z1e5mu8a1e5mu8b1e5mu8c1e5mu8d1e5mu8e1e5mu8f1e5mu8g1e5mu8h1e5mu8i1e5mu8j1e5mu8k1e5mu8l1e5mu8m1e5mu8n1e5mu8o1e5mu8p1e5mu8q1e5mu8r1e5mu8s1e5mu8t1e5mu8u1e5mu8v1e5mu8w1
ECOD domains from experimental PDB structures interacting with ligand JNI