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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03421555

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
B08A,B2E990.72
BDBA,B1KE30.74
PTF[(METHYLSULFANYL)METHYL]BENZENEC,F1RHQ0.73
B69A2ZCR0.83
PBAPHENYLETHANE BORONIC ACIDC,G6CHA0.71
FPRPROPYLBENZENEC1RHK0.7
FEP[(4-{4-[4-(DIFLUORO-PHOSPHONO-METHYL)-
PHENYL]-BUTYL}-PHENYL)-DIFLUORO-
METHYL]-PHOSPHONIC ACID
A1KAV0.76
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1DPM0.83
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1P6B0.83
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1PSC0.83
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B3E3H0.83
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1QW70.83
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1P6C0.83
1PB1,4-DIPHENYL-2-BUTENEA,B1OJ90.75
2HSHEXYLPHOSPHONIC ACID (S)-2-METHYL-
3-PHENYLPROPYL ESTER
X1YS20.81
B70tripotassium (1R)-4-biphenyl-4-
yl-1-phosphonatobutane-1-sulfonate
A2ZCS0.82
2HRHEXYLPHOSPHONIC ACID (R)-2-METHYL-
3-PHENYLPROPYL ESTER
X1YS10.81
787(PHENYL-PHOSPHONO-METHYL)-PHOSPHONIC ACIDA1O4R0.71
I4BISOBUTYLBENZENEA184L0.71
B28A,B2E9A0.71
PYLPHENYLETHANEC1B070.7
PYLPHENYLETHANEA,B2VRM0.7
PYLPHENYLETHANEA1NHB0.7
N4BN-BUTYLBENZENEA186L0.7