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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02849103

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
RBE3-(BENZOYLOXY)-8-AZA-BICYCLO[3.2.1]OCTANE-
2-CARBOXYLIC ACID
H1RIU0.71
PTMALPHA-METHYL-O-PHOSPHOTYROSINEH,L1JYQ0.72
SAL2-HYDROXYBENZOIC ACIDA2I2Z0.72
SAL2-HYDROXYBENZOIC ACIDA,B,C1FIQ0.72
SAL2-HYDROXYBENZOIC ACIDA2I300.72
SAL2-HYDROXYBENZOIC ACIDA,B1PTH0.72
SAL2-HYDROXYBENZOIC ACIDA,B3DEU0.72
SAL2-HYDROXYBENZOIC ACIDA,B,C,D2E1Q0.72
SAL2-HYDROXYBENZOIC ACIDA,B3HGX0.72
SAL2-HYDROXYBENZOIC ACIDA,B3BPX0.72
SAL2-HYDROXYBENZOIC ACIDA1WYG0.72
SAL2-HYDROXYBENZOIC ACIDA1JGS0.72
SAL2-HYDROXYBENZOIC ACIDX1M6E0.72
SAL2-HYDROXYBENZOIC ACIDA3B9M0.72
SAL2-HYDROXYBENZOIC ACIDA,B1FO40.72
SAL2-HYDROXYBENZOIC ACIDA,B1Y7I0.72
SAL2-HYDROXYBENZOIC ACIDA,B2FN10.72
SEM3-AMINO-4-OXYBENZYL-2-BUTANONEA,B1THE0.71
BJH1(R)-1-ACETAMIDO-2-(3-CARBOXY-2-
HYDROXYPHENYL)ETHYL BORONIC ACID
A1ERQ0.73
1NH(2E,6E)-8-[(3-BENZOYLBENZYL)OXY]-
3,7-DIMETHYLOCTA-2,6-DIENYL TRIHYDROGEN DIPHOSPHATE
B1O1S0.7
OBE3-(3-HYDROXY-BENZOYLOXY)-8-METHYL-
8-AZA-BICYCLO[3.2.1]OCTANE-2-CARBOXYLIC ACID
H1RIV0.71
SCLACETIC ACID SALICYLOYL-AMINO-ESTERA1EBV0.71
AI73-(heptyloxy)benzoic acidA,B2O3Z0.71
AIN2-(ACETYLOXY)BENZOIC ACIDA3GCL0.76
AIN2-(ACETYLOXY)BENZOIC ACIDA2QQT0.76
AIN2-(ACETYLOXY)BENZOIC ACIDA1TGM0.76
AIN2-(ACETYLOXY)BENZOIC ACIDA2G5J0.76
AIN2-(ACETYLOXY)BENZOIC ACIDA1OXR0.76
AIN2-(ACETYLOXY)BENZOIC ACIDA3HWY0.76
GRE2,6-DIHYDROXYBENZOIC ACIDA,B,C,D2DVU0.7
219CYCLOHEXYLMETHYL 2-FORMYLPHENYL HYDROGEN PHOSPHATEA1O4I0.77
PTRO-PHOSPHOTYROSINEP1AYC0.76
PTRO-PHOSPHOTYROSINEB1G1F0.76
PTRO-PHOSPHOTYROSINEA,C2CJM0.76
PTRO-PHOSPHOTYROSINEA2PVF0.76
PTRO-PHOSPHOTYROSINEA,B1KC20.76
PTRO-PHOSPHOTYROSINEA2CJZ0.76
PTRO-PHOSPHOTYROSINEA,B2HMH0.76
PTRO-PHOSPHOTYROSINEB1SHB0.76
PTRO-PHOSPHOTYROSINEA,B,C,D1K4S0.76
PTRO-PHOSPHOTYROSINEA,B3DK70.76
PTRO-PHOSPHOTYROSINEB,D,P2HWL0.76
PTRO-PHOSPHOTYROSINEA,B2W1I0.76
PTRO-PHOSPHOTYROSINEA,B1P7D0.76
PTRO-PHOSPHOTYROSINEE,I1ZFP0.76
PTRO-PHOSPHOTYROSINEA,B3BU60.76
PTRO-PHOSPHOTYROSINEC,D1A070.76
PTRO-PHOSPHOTYROSINEA3BU30.76
PTRO-PHOSPHOTYROSINEA,B2V7A0.76
PTRO-PHOSPHOTYROSINEB1CSY0.76
PTRO-PHOSPHOTYROSINEA3LCK0.76
PTRO-PHOSPHOTYROSINEI1TZE0.76
PTRO-PHOSPHOTYROSINEB1I3Z0.76
PTRO-PHOSPHOTYROSINEA,G3CI50.76
PTRO-PHOSPHOTYROSINEA,B1YVH0.76
PTRO-PHOSPHOTYROSINEA,B2HCK0.76
PTRO-PHOSPHOTYROSINEA3BUN0.76
PTRO-PHOSPHOTYROSINEA,B2B7A0.76
PTRO-PHOSPHOTYROSINEA,B1GNG0.76
PTRO-PHOSPHOTYROSINEA,B2OQ10.76
PTRO-PHOSPHOTYROSINEA1IR30.76
PTRO-PHOSPHOTYROSINEB1CSZ0.76
PTRO-PHOSPHOTYROSINEB1PTT0.76
PTRO-PHOSPHOTYROSINEB1KA60.76
PTRO-PHOSPHOTYROSINEC,D1A1C0.76
PTRO-PHOSPHOTYROSINEB1LKL0.76
PTRO-PHOSPHOTYROSINEA1UUS0.76
PTRO-PHOSPHOTYROSINEA,B1AD50.76
PTRO-PHOSPHOTYROSINEA1O9U0.76
PTRO-PHOSPHOTYROSINEA,B3DK60.76
PTRO-PHOSPHOTYROSINEA,B2I6O0.76
PTRO-PHOSPHOTYROSINEA1PTY0.76
PTRO-PHOSPHOTYROSINEA,B1TRN0.76
PTRO-PHOSPHOTYROSINEB1M0V0.76
PTRO-PHOSPHOTYROSINEB2G350.76
PTRO-PHOSPHOTYROSINEA,B3D420.76
PTRO-PHOSPHOTYROSINEA,B2C0T0.76
PTRO-PHOSPHOTYROSINEA,B2CBL0.76
PTRO-PHOSPHOTYROSINEA1KSW0.76
PTRO-PHOSPHOTYROSINEA,B2OW30.76
PTRO-PHOSPHOTYROSINEB1PTU0.76
PTRO-PHOSPHOTYROSINEA2ZM10.76
PTRO-PHOSPHOTYROSINEB,C2H5K0.76
PTRO-PHOSPHOTYROSINEA,B1PKG0.76
PTRO-PHOSPHOTYROSINEA3C7Q0.76
PTRO-PHOSPHOTYROSINEB2H7D0.76
PTRO-PHOSPHOTYROSINEP,Q1AYA0.76
PTRO-PHOSPHOTYROSINEA2ZYB0.76
PTRO-PHOSPHOTYROSINEL,M2CI90.76
PTRO-PHOSPHOTYROSINEI1BMB0.76
PTRO-PHOSPHOTYROSINEP1AOT0.76
PTRO-PHOSPHOTYROSINEA2ERK0.76
PTRO-PHOSPHOTYROSINEB2IUH0.76
PTRO-PHOSPHOTYROSINEB1G1H0.76
PTRO-PHOSPHOTYROSINEA,B3FUP0.76
PTRO-PHOSPHOTYROSINEL1JYR0.76
PTRO-PHOSPHOTYROSINEA3CLY0.76
PTRO-PHOSPHOTYROSINEA2AUH0.76
PTRO-PHOSPHOTYROSINEA,B,C,D,E,F,
G,H
1R1P0.76
PTRO-PHOSPHOTYROSINEA,C,D1T8I0.76
PTRO-PHOSPHOTYROSINEX2H7F0.76
PTRO-PHOSPHOTYROSINEA2ZM40.76
PTRO-PHOSPHOTYROSINEG,H,I,J,K,L2HDX0.76
PTRO-PHOSPHOTYROSINEA1QPJ0.76
PTRO-PHOSPHOTYROSINEA,B2EU00.76
PTRO-PHOSPHOTYROSINEA,C1NZV0.76
PTRO-PHOSPHOTYROSINEA,B,C,D2B4S0.76
PTRO-PHOSPHOTYROSINEB2PLD0.76
PTRO-PHOSPHOTYROSINEC,D,E,F1XXP0.76
PTRO-PHOSPHOTYROSINEA2QOQ0.76
PTRO-PHOSPHOTYROSINEA1HCT0.76
PTRO-PHOSPHOTYROSINEA,B,C,D2ZM30.76
PTRO-PHOSPHOTYROSINEB1LKK0.76
PTRO-PHOSPHOTYROSINEA,B,C,D1YVL0.76
PTRO-PHOSPHOTYROSINEB2Z8P0.76
PTRO-PHOSPHOTYROSINEA1UUR0.76
PTRO-PHOSPHOTYROSINEB,D,F,H,J,L1A810.76
PTRO-PHOSPHOTYROSINEB1LCK0.76
PTRO-PHOSPHOTYROSINEA2QO70.76
PTRO-PHOSPHOTYROSINEB1FPR0.76
PTRO-PHOSPHOTYROSINEA3BUM0.76
PTRO-PHOSPHOTYROSINEB2FCI0.76
PTRO-PHOSPHOTYROSINEA2QYQ0.76
PTRO-PHOSPHOTYROSINEA3BYM0.76
PTRO-PHOSPHOTYROSINEA2OH40.76
PTRO-PHOSPHOTYROSINEB1G1G0.76
PTRO-PHOSPHOTYROSINEB1SHC0.76
PTRO-PHOSPHOTYROSINEA1BF50.76
PTRO-PHOSPHOTYROSINEH,L1JYQ0.76
PTRO-PHOSPHOTYROSINEA2Z8C0.76
PTRO-PHOSPHOTYROSINEA,B1CM80.76
PTRO-PHOSPHOTYROSINEB,D3DA90.76
PTRO-PHOSPHOTYROSINEA,L2CIA0.76
PTRO-PHOSPHOTYROSINEX2DQ70.76
PTRO-PHOSPHOTYROSINEA,P2VIF0.76
PTRO-PHOSPHOTYROSINEB1F1W0.76
PTRO-PHOSPHOTYROSINED,E,F1SPS0.76
PTRO-PHOSPHOTYROSINEA,B2C0I0.76
PTRO-PHOSPHOTYROSINEB1OO40.76
PTRO-PHOSPHOTYROSINEA,C,D1A310.76
PTRO-PHOSPHOTYROSINEA,B,C,D,E,F,
G,H
1R1S0.76
PTRO-PHOSPHOTYROSINEA,B,C,D1NH30.76
PTRO-PHOSPHOTYROSINEB1TCE0.76
PTRO-PHOSPHOTYROSINEA,B2ETZ0.76
PTRO-PHOSPHOTYROSINEC,D1A1B0.76
PTRO-PHOSPHOTYROSINEA,B1FBV0.76
PTRO-PHOSPHOTYROSINEA1QCF0.76
PTRO-PHOSPHOTYROSINEA,B3F880.76
PTRO-PHOSPHOTYROSINEA2PTK0.76
PTRO-PHOSPHOTYROSINEA1QPD0.76
PTRO-PHOSPHOTYROSINEA,B1RRJ0.76
PTRO-PHOSPHOTYROSINEA,C,D1K4T0.76
PTRO-PHOSPHOTYROSINEA1YWN0.76
PTRO-PHOSPHOTYROSINEA,B,C,D1R1Q0.76
PTRO-PHOSPHOTYROSINEA,B,E,F1RQQ0.76
PTRO-PHOSPHOTYROSINEA3EYH0.76
PTRO-PHOSPHOTYROSINEA,B,C,D2VX30.76
PTRO-PHOSPHOTYROSINEA,B1YRK0.76
PTRO-PHOSPHOTYROSINEP1AYB0.76
PTRO-PHOSPHOTYROSINEC,D1D4W0.76
PTRO-PHOSPHOTYROSINEA1YVJ0.76
PTRO-PHOSPHOTYROSINEA,B2GQG0.76
PTRO-PHOSPHOTYROSINEA1PTV0.76
PTRO-PHOSPHOTYROSINEB1FU50.76
PTRO-PHOSPHOTYROSINEA1BG10.76
PTRO-PHOSPHOTYROSINEA2IVT0.76
PTRO-PHOSPHOTYROSINEP1J4K0.76
PTRO-PHOSPHOTYROSINEP1AOU0.76
PTRO-PHOSPHOTYROSINEA,C,D1TL80.76
PTRO-PHOSPHOTYROSINEA2DVJ0.76
PTRO-PHOSPHOTYROSINEA,B2J170.76
PTRO-PHOSPHOTYROSINEA,C3BUW0.76
PTRO-PHOSPHOTYROSINEB2PLE0.76
PTRO-PHOSPHOTYROSINEB2BBU0.76
PTRO-PHOSPHOTYROSINEC,D1M6X0.76
PTRO-PHOSPHOTYROSINEA,C1RR80.76
PTRO-PHOSPHOTYROSINEA2J0L0.76
PTRO-PHOSPHOTYROSINEB1JU50.76
PTRO-PHOSPHOTYROSINEA2H8H0.76
PTRO-PHOSPHOTYROSINEB2NMB0.76
PTRO-PHOSPHOTYROSINEC,D,H1P4E0.76
PTRO-PHOSPHOTYROSINEA,B1Z1B0.76
PTRO-PHOSPHOTYROSINEA3BU50.76
PTRO-PHOSPHOTYROSINEI1QG10.76
PTRO-PHOSPHOTYROSINEA,C1SC70.76
PTRO-PHOSPHOTYROSINEA3E620.76
PTRO-PHOSPHOTYROSINEA,C3BUX0.76
PTRO-PHOSPHOTYROSINEB2DXP0.76
PTRO-PHOSPHOTYROSINEB2Q8Y0.76
PTRO-PHOSPHOTYROSINEA,C1NZL0.76
PTRO-PHOSPHOTYROSINEA,B,C,D1YGU0.76
PTRO-PHOSPHOTYROSINEA2IVU0.76
PTRO-PHOSPHOTYROSINEA,B1U540.76
PTRO-PHOSPHOTYROSINEA,B,C,D1P130.76
PTRO-PHOSPHOTYROSINEI,J,K,L1FYR0.76
PTRO-PHOSPHOTYROSINEA,C,D1SEU0.76
PTRO-PHOSPHOTYROSINEB1SHD0.76
PTRO-PHOSPHOTYROSINEA,B3CD30.76
PTRO-PHOSPHOTYROSINEA2QOB0.76
PTRO-PHOSPHOTYROSINEB2H7E0.76
PTRO-PHOSPHOTYROSINEB1PIC0.76
PTRO-PHOSPHOTYROSINEA3EYG0.76
PTRO-PHOSPHOTYROSINEA1FMK0.76
PTRO-PHOSPHOTYROSINEA3E630.76
PTRO-PHOSPHOTYROSINEC,D1A1E0.76
PTRO-PHOSPHOTYROSINEA1QPC0.76
PTRO-PHOSPHOTYROSINEP1FHR0.76
PTRO-PHOSPHOTYROSINEB1H9O0.76
PTRO-PHOSPHOTYROSINEA,B1GAG0.76
PTRO-PHOSPHOTYROSINEB2YU70.76
PTRO-PHOSPHOTYROSINEA1HCS0.76
PTRO-PHOSPHOTYROSINEA,B,C,D3DQW0.76
PTRO-PHOSPHOTYROSINEA3BYO0.76
PTRO-PHOSPHOTYROSINEA,B1EEO0.76
PTRO-PHOSPHOTYROSINEC,D2IUI0.76
PTRO-PHOSPHOTYROSINEA,B,C,D1YGR0.76
PTRO-PHOSPHOTYROSINEB2RMX0.76
PTRO-PHOSPHOTYROSINEA,B3F7Z0.76
PTRO-PHOSPHOTYROSINEB1LCJ0.76
PTRO-PHOSPHOTYROSINEA3E640.76
PTRO-PHOSPHOTYROSINEL1BM20.76
PTRO-PHOSPHOTYROSINEB2ROR0.76
PTRO-PHOSPHOTYROSINEA,C3EB00.76
PTRO-PHOSPHOTYROSINEA2SRC0.76
PTRO-PHOSPHOTYROSINEA,B1EEN0.76
PTRO-PHOSPHOTYROSINEB1SHA0.76
PTRO-PHOSPHOTYROSINEA,B1YI60.76
PTRO-PHOSPHOTYROSINEP1K2M0.76
PTRO-PHOSPHOTYROSINEA2IVV0.76
PTRO-PHOSPHOTYROSINEB1IRS0.76
PTRO-PHOSPHOTYROSINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,R,S,T
3F5P0.76
PTRO-PHOSPHOTYROSINEA,B2ZOQ0.76
PTRO-PHOSPHOTYROSINEA,C3BUO0.76
PTRO-PHOSPHOTYROSINEA2QON0.76
PTRO-PHOSPHOTYROSINEA,B3FXX0.76
PTRO-PHOSPHOTYROSINEA1QPE0.76
PTRO-PHOSPHOTYROSINEB1MW40.76
PTRO-PHOSPHOTYROSINED1J4X0.76
PTRO-PHOSPHOTYROSINEA1K3A0.76
PTRO-PHOSPHOTYROSINEA,B2C0O0.76
PTRO-PHOSPHOTYROSINEA,B,C,D,E,F,
I,J,K,L,M,N
1X270.76
PTRO-PHOSPHOTYROSINEA,B3D440.76
PTRO-PHOSPHOTYROSINEA,B1Z190.76
PTRO-PHOSPHOTYROSINEA2OFU0.76
PTHCE1-METHYLENE-HYDROXY-PHOSPHOTYROSINEC,D1A090.77
PTHCE1-METHYLENE-HYDROXY-PHOSPHOTYROSINEC,D1A1A0.77
2PB2-[(DIOXIDOPHOSPHINO)OXY]BENZOATEA1SDE0.81
MPB4-HYDROXY-BENZOIC ACID METHYL ESTERB,C,D2VK00.71
MPB4-HYDROXY-BENZOIC ACID METHYL ESTERA,B,D3MTH0.71
PSNBENZYL 2-FORMYLPHENYL HYDROGEN PHOSPHATEA1O4K0.76
3002-FORMYL-6-METHOXYPHENYL DIHYDROGEN PHOSPHATEA1O410.75
2992,6-DIFORMYL-4-METHYLPHENYL DIHYDROGEN PHOSPHATEA1O4E0.75
2622-FORMYLPHENYL DIHYDROGEN PHOSPHATEA1O4D0.77
1592-HYDROXY-5-(2-MERCAPTO-ETHYLSULFAMOYL)-
BENZOIC ACID
A,B1NME0.72