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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02640682

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BTMN-benzyl-N,N-diethylethanaminiumA,B2Q9Y0.7
2BFALPHA-BENZYL-AMINOBENZYL-PHOSPHONIC ACIDA,B,C,D1ND50.7
1504,5-DIMETHYL-1,2-PHENYLENEDIAMINEA1L4F0.7
CLCN-ACETYL-P-NITROPHENYLSERINOLA1GRR0.71
BANHONH-BENZYLMALONYL-L-ALANYLGLYCINE-
P-NITROANILIDE
A5TLN0.75
34A3,4-DIMETHYLANILINEA1L4K0.72
4NM4-NITROPHENYL METHANETHIOLA,B2VO40.75
271N-methyl-1-phenylmethanamineX2RBT0.71
3NT3-NITROTOLUENEA,B2BMR0.78
3NT3-NITROTOLUENEA,B2HMO0.78
DBP1,3-DIAMINOBENZYL PHENYLALANINEA1A850.75
BASN-(1-PHENYL-PROPYL)-FORMAMIDEE,F,G,H1NJU0.7
BASN-(1-PHENYL-PROPYL)-FORMAMIDEY,Z1JQ70.7
BASN-(1-PHENYL-PROPYL)-FORMAMIDEC1NKM0.7
CVICRYSTAL VIOLETA,B,D,E1JTX0.72
AAHH1KEL0.73
AAHB,H1FL60.73
264(phenylamino)acetonitrileA2RBN0.73
3CZ(2R)-1-[(4-tert-butylphenyl)sulfonyl]-
2-methyl-4-(4-nitrophenyl)piperazine
A,B3CZR0.73
AU44,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)A2PYZ0.81
AFF2-ACETYLAMINOFLUORENE-3-YLA2GE20.7
A8BA1ODC0.71
1MRN-METHYLANILINEX2OTZ0.71