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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03080310

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
OVA3,4-DIHYDROXY-2-METHOXY-4-METHYL-
3-[2-METHYL-3-(3-METHYL-BUT-2-ENYL) -
OXIRANYL]-CYCLOHEXANONE
A2GZ50.72
OVA3,4-DIHYDROXY-2-METHOXY-4-METHYL-
3-[2-METHYL-3-(3-METHYL-BUT-2-ENYL) -
OXIRANYL]-CYCLOHEXANONE
A1B590.72
20E(2beta,3beta,5beta,22R)-2,3,14,20,22,25-
hexahydroxycholest-7-en-6-one
A,D2R400.72
SIMSIMVASTATINA,B,C,D1HW90.7
WINmethyl (5beta,7alpha,9beta,10alpha,11alpha,12alpha,13beta,15alpha)-
15-{[(2E)-3,4-dimethylpent-2-enoyl]oxy}-
3,11,12-trihydroxy-2,16-dioxo-13,20-
epoxypicras-3-en-21-oate
0,1,2,3,9,A,
B,C,F,H,J,K,
L,M,N,O,Q,R,
S,T,U,Y,Z
3G710.75
B2S(3alpha,7alpha)-3,7,15-trihydroxy-
12,13-epoxytrichothec-9-en-8-one
A3B2S0.7
FKPMETHYLPIPERAZINOFORSKOLINA,B,C3E8A0.76
FKPMETHYLPIPERAZINOFORSKOLINA,C2GVZ0.76
FKPMETHYLPIPERAZINOFORSKOLINA,C2GVD0.76
FKPMETHYLPIPERAZINOFORSKOLINA,C1AZS0.76
P1A2,3,14,20,22-PENTAHYDROXYCHOLEST-
7-EN-6-ONE
A,D1R1K0.72
P1A2,3,14,20,22-PENTAHYDROXYCHOLEST-
7-EN-6-ONE
E,U1Z5X0.72
P1A2,3,14,20,22-PENTAHYDROXYCHOLEST-
7-EN-6-ONE
E,F,G,H2NXX0.72
FOKFORSKOLINA,C3C160.94
FOKFORSKOLINA,C1CJU0.94
FOKFORSKOLINA,C1TL70.94
FOKFORSKOLINA,B1AB80.94
FOKFORSKOLINA,C3C140.94
FOKFORSKOLINA,C1CJT0.94
FOKFORSKOLINA,B,C1CUL0.94
FOKFORSKOLINA,C1CJV0.94
FOKFORSKOLINA,C3C150.94
FOKFORSKOLINA,C1U0H0.94
FOKFORSKOLINA,B,C1CS40.94
FOKFORSKOLINA,C1CJK0.94