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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00458815

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2HRHEXYLPHOSPHONIC ACID (R)-2-METHYL-
3-PHENYLPROPYL ESTER
X1YS10.7
2HSHEXYLPHOSPHONIC ACID (S)-2-METHYL-
3-PHENYLPROPYL ESTER
X1YS20.7
PEYPHENANTHRENEA,B2HML0.83
PEYPHENANTHRENEA,B2HMK0.83
787(PHENYL-PHOSPHONO-METHYL)-PHOSPHONIC ACIDA1O4R0.7
B70tripotassium (1R)-4-biphenyl-4-
yl-1-phosphonatobutane-1-sulfonate
A2ZCS0.75
FPRPROPYLBENZENEC1RHK0.74
AN3ANTHRACENEA,B2HMN0.83
AN3ANTHRACENEA,B2HMM0.83
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1DPM0.73
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1P6B0.73
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1PSC0.73
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B3E3H0.73
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1QW70.73
EBPDIETHYL 4-METHYLBENZYLPHOSPHONATEA,B1P6C0.73
B69A2ZCR0.76
I4BISOBUTYLBENZENEA184L0.74
B08A,B2E990.75
BDBA,B1KE30.78
1PB1,4-DIPHENYL-2-BUTENEA,B1OJ90.79
OXEORTHO-XYLENEA,B3E0X0.77
OXEORTHO-XYLENEA188L0.77
PXYPARA-XYLENEA187L0.74
PXYPARA-XYLENEA225L0.74
NPYNAPHTHALENEA,B1O7G0.78
PBAPHENYLETHANE BORONIC ACIDC,G6CHA0.72
MBNTOLUENEA,B3D7O0.71
MBNTOLUENEA,B1R1X0.71
MBNTOLUENEA,B1JLX0.71
MBNTOLUENEA,B,C,D3D170.71
MBNTOLUENEA,B2VRL0.71
MBNTOLUENEA,I2Z3E0.71
MBNTOLUENEA,B1YZI0.71
MBNTOLUENEA,B2DN10.71
MBNTOLUENEA,B3EN10.71
KTP(2-NAPHTHALEN-2-YL-1-NAPHTHALEN-
1-YL-2-OXO-ETHYL)-PHOSPHONIC ACID
A,B1KYN0.7
GW5(2E)-3-{4-[(1E)-1,2-DIPHENYLBUT-
1-ENYL]PHENYL}ACRYLIC ACID
A,B,C1R5K0.73
N4BN-BUTYLBENZENEA186L0.74
PYLPHENYLETHANEC1B070.74
PYLPHENYLETHANEA,B2VRM0.74
PYLPHENYLETHANEA1NHB0.74
FEP[(4-{4-[4-(DIFLUORO-PHOSPHONO-METHYL)-
PHENYL]-BUTYL}-PHENYL)-DIFLUORO-
METHYL]-PHOSPHONIC ACID
A1KAV0.75
FNP{[7-(DIFLUORO-PHOSPHONO-METHYL)-
NAPHTHALEN-2-YL]-DIFLUORO-METHYL}-
PHOSPHONIC ACID
A1KAK0.75
P4PTETRAPHENYLPHOSPHONIUMA,M1EXJ0.74
P4PTETRAPHENYLPHOSPHONIUMA,C3B620.74
P4PTETRAPHENYLPHOSPHONIUMA,B1R8E0.74
P4PTETRAPHENYLPHOSPHONIUMA2BOW0.74
P4PTETRAPHENYLPHOSPHONIUMA3B5D0.74
B28A,B2E9A0.76
DENINDENEA183L0.71