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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02599715

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
ROSN,N'-TETRAMETHYL-ROSAMINEA1F1T0.8
4BGN-[4-(benzyloxy)phenyl]glycinamideA3CHO0.72
ZZ14-METHYL-2H-CHROMEN-2-ONEA2CIP0.71
GP81-(2-AMIDINOPHENYL)-3-(PHENOXYPHENYL)UREAA1BJV0.76
3MR(4S)-4-(2-AMINO-6-PHENOXYQUINAZOLIN-
3(4H)-YL)-N,4-DICYCLOHEXYL-N-METHYLBUTANAMIDE
A2Q150.7
4BS4-amino-N-[4-(benzyloxy)phenyl]butanamideA3CHR0.72
3232-[3,6-bis(dimethylamino)xanthen-
9-yl]-5-methanoyl-benzoate
A,P,Q3D1F0.73
CZM'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)-
BENZENE-1,2-DIAMINE'
A1J3F0.72
CZM'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)-
BENZENE-1,2-DIAMINE'
A1UFJ0.72
CZM'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)-
BENZENE-1,2-DIAMINE'
A1V9Q0.72
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEA,B,C,D,I,J,
K,L
3EWF0.8
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEA,B,I,L2V5W0.8
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEB1VDN0.8
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEC1VAI0.8
YOK[[2,2'-[4-CARBOXYETHYL-1,2-PHENYLENEBIS(NITRILOMETHYLIDYNE)]BIS[PHENOLATO]](2-
)-N,N',O,O']-IRON
A,B1WZD0.71
T4BA2NNQ0.7
RHQRHODAMINE 6GA,B,D,E1JUS0.73
RHQRHODAMINE 6GA,B,D,E3BR50.73
RHQRHODAMINE 6GA,D,E3BR60.73
RHQRHODAMINE 6GA,B3D6Z0.73
RHQRHODAMINE 6GA1OY80.73
RHQRHODAMINE 6GA1T9V0.73
YOM2,2'-[1,2-PHENYLENEBIS(NITRILOMETHYLIDYNE)]BIS[PHENOLATO]](2-
)-N,N',O,O']-IRON
A,B1WZG0.71