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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02546039

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
T1D5-(4-METHOXYBIPHENYL-3-YL)-1,2,5-
THIADIAZOLIDIN-3-ONE 1,1-DIOXIDE
A2BGD0.73
4BS4-amino-N-[4-(benzyloxy)phenyl]butanamideA3CHR0.73
RFX(3R)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-
1-amine
A3GWV0.7
DID4,4'[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDAMIDEA,B,C,D1RPW0.7
505(2R)-1-(2,6-dimethylphenoxy)propan-
2-amine
A2VIN0.7
SFX(3S)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-
1-amine
A3GWW0.7
MXX5,8-dimethoxy-1,4-dimethylquinolin-
2(1H)-one
A,B3GAM0.71
4BGN-[4-(benzyloxy)phenyl]glycinamideA3CHO0.73
B11N-[3-(4-FLUOROPHENOXY)PHENYL]-4-
[(2-HYDROXYBENZYL)AMINO]PIPERIDINE-
1-SULFONAMIDE
A1ZZ20.73
NIM4-NITRO-2-PHENOXYMETHANESULFONANILIDEA1ZWP0.72
NIM4-NITRO-2-PHENOXYMETHANESULFONANILIDEA3E9X0.72
NIM4-NITRO-2-PHENOXYMETHANESULFONANILIDEA2OTH0.72
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEA,B,C,D,I,J,
K,L
3EWF0.85
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEA,B,I,L2V5W0.85
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEB1VDN0.85
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEC1VAI0.85
451N-(6,7,9,10,17,18,20,21-octahydrodibenzo[b,k][1,4,7,10,13,16]hexaoxacyclooctadecin-
2-yl)acetamide
A3FYX0.71
SNO(S)-PARA-NITROSTYRENE OXIDEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
1ZO80.71
2AC2-AMINO-P-CRESOLH,I1A2C0.73
2AC2-AMINO-P-CRESOLA1L4M0.73
RNO(R)-PARA-NITROSTYRENE OXIDEA,B,C,D1ZMT0.71
ZHZ2-(4-METHOXYPHENYL)ACETAMIDED,H2HKR0.71
N4EN-(4-ethoxyphenyl)acetamideA,B,C,D3EBS0.7
MAZFORMIC ACID 3-AMINO-BENZYL ESTERH,L1JYQ0.72
ZHH2-(4-METHOXYPHENYL)ETHANAMINED,H2HKR0.75
GVB(3R,4S)-1-(3,4-DIMETHOXYPHENYL)-
3-(3-METHYLPHENYL)PIPERIDIN-4-AMINE
A,B2JID0.77
HV71-METHYLAMINE-2-HYDROXY-4-METHOXY-
BENZENE
C1A8G0.72
PZM1-(4-METHOXYPHENYL)METHANAMINEA,D,H2HJB0.77
ROSN,N'-TETRAMETHYL-ROSAMINEA1F1T0.77
SOAISATOIC ANHYDRIDEA1BIO0.7