TTD_Target_ID Target_Name TTD_Drug_ID Drug_Name Drug_Highest_Status Drug_PubchemID Molecular_Formula Molecular_Weight Canonical_SMILES Activity Binder_Type T38338 Voltage-gated calcium channel alpha Cav2.2 D00BPA Olomoucine Terminated 4592 C15H18N6O 298.34 CN1C=NC2=C(N=C(N=C21)NCCO)NCC3=CC=CC=C3 EC50 > 1000000 nM Non binder T38338 Voltage-gated calcium channel alpha Cav2.2 B1X9YS 8-Bromo-5H-indolo[3,2-c]quinolin-6(11H)-one Investigative 71457749 C15H9BrN2O 313.15 C1=CC=C2C(=C1)C3=C(C4=C(N3)C=CC(=C4)Br)C(=O)N2 EC50 > 1000000 nM Non binder T38338 Voltage-gated calcium channel alpha Cav2.2 B2HD7Q 6-Benzylamino-2-(2-hydroxyethylamino)-7-methylpurine Investigative 512292 C15H18N6O 298.34 CN1C=NC2=C1C(=NC(=N2)NCCO)NCC3=CC=CC=C3 EC50 > 1000000 nM Non binder T38338 Voltage-gated calcium channel alpha Cav2.2 B2VJ4I (2R)-2-[[6-(Dibenzylamino)-9-propan-2-ylpurin-2-yl]amino]butan-1-ol Investigative 71454199 C26H32N6O 444.6 CC[C@H](CO)NC1=NC2=C(C(=N1)N(CC3=CC=CC=C3)CC4=CC=CC=C4)N=CN2C(C)C EC50 > 1000000 nM Non binder T38338 Voltage-gated calcium channel alpha Cav2.2 B3I1VX Chembl4224809 Investigative 145969191 C25H24F3N3O5S 535.5 C1=CC(=CC=C1CNC2=NC3=C(S2)C=C(C=C3)OC4=CC=C(C=C4)O)OCCCN.C(=O)(C(F)(F)F)O IC50 = 205000 nM Non binder T38338 Voltage-gated calcium channel alpha Cav2.2 B3JXW8 N9-Isopropyl-olomoucine Investigative 6610355 C17H22N6O 326.4 CC(C)N1C=NC2=C(N=C(N=C21)NCCO)NCC3=CC=CC=C3 EC50 > 1000000 nM Non binder T38338 Voltage-gated calcium channel alpha Cav2.2 B3N8EG Dimethylamino-olomoucine Investigative 71452436 C17H23N7 325.4 CN1C=NC2=C(N=C(N=C21)NCCN(C)C)NCC3=CC=CC=C3 EC50 > 1000000 nM Non binder T38338 Voltage-gated calcium channel alpha Cav2.2 B4R8YH Chembl4228834 Investigative 145988617 C25H24F3N3O4S 519.5 C1=CC=C(C=C1)OC2=CC3=C(C=C2)N=C(S3)NCC4=CC=C(C=C4)OCCCN.C(=O)(C(F)(F)F)O IC50 = 218000 nM Non binder T38338 Voltage-gated calcium channel alpha Cav2.2 B5HRC3 Chembl4226078 Investigative 145969924 C27H25F6N3O4S 601.6 CN(CC1=CC=C(C=C1)OCCCN)C2=NC3=C(S2)C=C(C=C3)OC4=CC=C(C=C4)C(F)(F)F.C(=O)(C(F)(F)F)O IC50 = 283000 nM Non binder T38338 Voltage-gated calcium channel alpha Cav2.2 B6IVH3 Chembl4224963 Investigative 145968281 C28H27F6N5O4S 643.6 CN(CC1=CC=C(C=C1)OCCCN=C(N)N)C2=NC3=C(S2)C=C(C=C3)OC4=CC=CC(=C4)C(F)(F)F.C(=O)(C(F)(F)F)O IC50 = 202000 nM Non binder T38338 Voltage-gated calcium channel alpha Cav2.2 B6P9NA (S)-Seliciclib Investigative 6603989 C19H26N6O 354.4 CC[C@@H](CO)NC1=NC(=C2C(=N1)N(C=N2)C(C)C)NCC3=CC=CC=C3 EC50 = 570000 nM Non binder T38338 Voltage-gated calcium channel alpha Cav2.2 B8Q2YA Chembl4226136 Investigative 145968567 C26H25F4N5O4S 579.6 C1=CC(=CC=C1CNC2=NC3=C(S2)C=C(C=C3)OC4=CC=C(C=C4)F)OCCCN=C(N)N.C(=O)(C(F)(F)F)O IC50 = 244000 nM Non binder T38338 Voltage-gated calcium channel alpha Cav2.2 BDEC08 Chembl4225014 Investigative 145969886 C26H26F3N5O5S 577.6 C1=CC(=CC=C1CNC2=NC3=C(S2)C=C(C=C3)OC4=CC=C(C=C4)O)OCCCN=C(N)N.C(=O)(C(F)(F)F)O IC50 = 253000 nM Non binder T38338 Voltage-gated calcium channel alpha Cav2.2 BF2JP0 Chembl4229102 Investigative 145988629 C27H25F3N6O4S 586.6 C1=CC(=CC=C1CNC2=NC3=C(S2)C=C(C=C3)OC4=CC=C(C=C4)C#N)OCCCN=C(N)N.C(=O)(C(F)(F)F)O IC50 = 368000 nM Non binder T38338 Voltage-gated calcium channel alpha Cav2.2 BM1SQ6 Chembl4226327 Investigative 145969488 C27H28F3N5O5S 591.6 CN(CC1=CC=C(C=C1)OCCCN=C(N)N)C2=NC3=C(S2)C=C(C=C3)OC4=CC=C(C=C4)O.C(=O)(C(F)(F)F)O IC50 = 432000 nM Non binder T38338 Voltage-gated calcium channel alpha Cav2.2 BSTI37 Aftin-4 Investigative 5289296 C20H28N6O 368.5 CC[C@H](CO)NC1=NC2=C(C(=N1)N(C)CC3=CC=CC=C3)N=CN2C(C)C EC50 > 1000000 nM Non binder T38338 Voltage-gated calcium channel alpha Cav2.2 D07ADR BOHEMINE Investigative 2422 C18H24N6O 340.4 CC(C)N1C=NC2=C(N=C(N=C21)NCCCO)NCC3=CC=CC=C3 EC50 > 1000000 nM Non binder T38338 Voltage-gated calcium channel alpha Cav2.2 D0Y0ES Indirubin-3'-monoxime Investigative 3707 C16H11N3O2 277.28 C1=CC=C2C(=C1)C(=C(N2)O)C3=C(C4=CC=CC=C4N3)N=O EC50 > 1000000 nM Non binder