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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00005723

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DID4,4'[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDAMIDEA,B,C,D1RPW0.7
T1D5-(4-METHOXYBIPHENYL-3-YL)-1,2,5-
THIADIAZOLIDIN-3-ONE 1,1-DIOXIDE
A2BGD0.75
4NL4-AMINOPHENOLA2ORL0.73
2AF2-AMINOPHENOLA1L4N0.76
PZM1-(4-METHOXYPHENYL)METHANAMINEA,D,H2HJB0.82
505(2R)-1-(2,6-dimethylphenoxy)propan-
2-amine
A2VIN0.73
4BGN-[4-(benzyloxy)phenyl]glycinamideA3CHO0.73
TY23-AMINO-L-TYROSINEA,B2VH30.73
EPN3-(4-NITRO-PHENOXY)-PROPAN-1-OLA2SAM0.71
ZHZ2-(4-METHOXYPHENYL)ACETAMIDED,H2HKR0.75
4BS4-amino-N-[4-(benzyloxy)phenyl]butanamideA3CHR0.72
ZHH2-(4-METHOXYPHENYL)ETHANAMINED,H2HKR0.81
MR11-(1,3-BENZODIOXOL-5-YL)METHANAMINEA2ORQ0.7
3MB3-METHOXYBENZAMIDEA3PAX0.72
2AC2-AMINO-P-CRESOLH,I1A2C0.85
2AC2-AMINO-P-CRESOLA1L4M0.85
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEA,B,C,D,I,J,
K,L
3EWF0.76
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEA,B,I,L2V5W0.76
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEB1VDN0.76
MCM7-AMINO-4-METHYL-CHROMEN-2-ONEC1VAI0.76
MAZFORMIC ACID 3-AMINO-BENZYL ESTERH,L1JYQ0.77
SOAISATOIC ANHYDRIDEA1BIO0.72
AZY3-AZIDO-L-TYROSINEA2YXN0.72
HV71-METHYLAMINE-2-HYDROXY-4-METHOXY-
BENZENE
C1A8G0.72
NCR2-NITRO-P-CRESOLA,B1AHV0.75
N4EN-(4-ethoxyphenyl)acetamideA,B,C,D3EBS0.75
NIM4-NITRO-2-PHENOXYMETHANESULFONANILIDEA1ZWP0.71
NIM4-NITRO-2-PHENOXYMETHANESULFONANILIDEA3E9X0.71
NIM4-NITRO-2-PHENOXYMETHANESULFONANILIDEA2OTH0.71