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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03407541

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PTMALPHA-METHYL-O-PHOSPHOTYROSINEH,L1JYQ0.72
BJH1(R)-1-ACETAMIDO-2-(3-CARBOXY-2-
HYDROXYPHENYL)ETHYL BORONIC ACID
A1ERQ0.74
MPB4-HYDROXY-BENZOIC ACID METHYL ESTERB,C,D2VK00.72
MPB4-HYDROXY-BENZOIC ACID METHYL ESTERA,B,D3MTH0.72
PTHCE1-METHYLENE-HYDROXY-PHOSPHOTYROSINEC,D1A090.76
PTHCE1-METHYLENE-HYDROXY-PHOSPHOTYROSINEC,D1A1A0.76
FRR(3R,5Z,8S,9S,11E)-8,9,16-TRIHYDROXY-
14-METHOXY-3-METHYL-3,4,9,10-TETRAHYDRO-
1H-2-BENZOXACYCLOTETRADECINE-1,7(8H)-
DIONE
A2E140.7
PSNBENZYL 2-FORMYLPHENYL HYDROGEN PHOSPHATEA1O4K0.78
ANN4-METHOXYBENZOIC ACIDA2B960.7
ANN4-METHOXYBENZOIC ACIDA2QUE0.7
ANN4-METHOXYBENZOIC ACIDA1SV30.7
ANN4-METHOXYBENZOIC ACIDA1O2E0.7
ANN4-METHOXYBENZOIC ACIDA,B,C,D3CBI0.7
PTRO-PHOSPHOTYROSINEP1AYC0.74
PTRO-PHOSPHOTYROSINEB1G1F0.74
PTRO-PHOSPHOTYROSINEA,C2CJM0.74
PTRO-PHOSPHOTYROSINEA2PVF0.74
PTRO-PHOSPHOTYROSINEA,B1KC20.74
PTRO-PHOSPHOTYROSINEA2CJZ0.74
PTRO-PHOSPHOTYROSINEA,B2HMH0.74
PTRO-PHOSPHOTYROSINEB1SHB0.74
PTRO-PHOSPHOTYROSINEA,B,C,D1K4S0.74
PTRO-PHOSPHOTYROSINEA,B3DK70.74
PTRO-PHOSPHOTYROSINEB,D,P2HWL0.74
PTRO-PHOSPHOTYROSINEA,B2W1I0.74
PTRO-PHOSPHOTYROSINEA,B1P7D0.74
PTRO-PHOSPHOTYROSINEE,I1ZFP0.74
PTRO-PHOSPHOTYROSINEA,B3BU60.74
PTRO-PHOSPHOTYROSINEC,D1A070.74
PTRO-PHOSPHOTYROSINEA3BU30.74
PTRO-PHOSPHOTYROSINEA,B2V7A0.74
PTRO-PHOSPHOTYROSINEB1CSY0.74
PTRO-PHOSPHOTYROSINEA3LCK0.74
PTRO-PHOSPHOTYROSINEI1TZE0.74
PTRO-PHOSPHOTYROSINEB1I3Z0.74
PTRO-PHOSPHOTYROSINEA,G3CI50.74
PTRO-PHOSPHOTYROSINEA,B1YVH0.74
PTRO-PHOSPHOTYROSINEA,B2HCK0.74
PTRO-PHOSPHOTYROSINEA3BUN0.74
PTRO-PHOSPHOTYROSINEA,B2B7A0.74
PTRO-PHOSPHOTYROSINEA,B1GNG0.74
PTRO-PHOSPHOTYROSINEA,B2OQ10.74
PTRO-PHOSPHOTYROSINEA1IR30.74
PTRO-PHOSPHOTYROSINEB1CSZ0.74
PTRO-PHOSPHOTYROSINEB1PTT0.74
PTRO-PHOSPHOTYROSINEB1KA60.74
PTRO-PHOSPHOTYROSINEC,D1A1C0.74
PTRO-PHOSPHOTYROSINEB1LKL0.74
PTRO-PHOSPHOTYROSINEA1UUS0.74
PTRO-PHOSPHOTYROSINEA,B1AD50.74
PTRO-PHOSPHOTYROSINEA1O9U0.74
PTRO-PHOSPHOTYROSINEA,B3DK60.74
PTRO-PHOSPHOTYROSINEA,B2I6O0.74
PTRO-PHOSPHOTYROSINEA1PTY0.74
PTRO-PHOSPHOTYROSINEA,B1TRN0.74
PTRO-PHOSPHOTYROSINEB1M0V0.74
PTRO-PHOSPHOTYROSINEB2G350.74
PTRO-PHOSPHOTYROSINEA,B3D420.74
PTRO-PHOSPHOTYROSINEA,B2C0T0.74
PTRO-PHOSPHOTYROSINEA,B2CBL0.74
PTRO-PHOSPHOTYROSINEA1KSW0.74
PTRO-PHOSPHOTYROSINEA,B2OW30.74
PTRO-PHOSPHOTYROSINEB1PTU0.74
PTRO-PHOSPHOTYROSINEA2ZM10.74
PTRO-PHOSPHOTYROSINEB,C2H5K0.74
PTRO-PHOSPHOTYROSINEA,B1PKG0.74
PTRO-PHOSPHOTYROSINEA3C7Q0.74
PTRO-PHOSPHOTYROSINEB2H7D0.74
PTRO-PHOSPHOTYROSINEP,Q1AYA0.74
PTRO-PHOSPHOTYROSINEA2ZYB0.74
PTRO-PHOSPHOTYROSINEL,M2CI90.74
PTRO-PHOSPHOTYROSINEI1BMB0.74
PTRO-PHOSPHOTYROSINEP1AOT0.74
PTRO-PHOSPHOTYROSINEA2ERK0.74
PTRO-PHOSPHOTYROSINEB2IUH0.74
PTRO-PHOSPHOTYROSINEB1G1H0.74
PTRO-PHOSPHOTYROSINEA,B3FUP0.74
PTRO-PHOSPHOTYROSINEL1JYR0.74
PTRO-PHOSPHOTYROSINEA3CLY0.74
PTRO-PHOSPHOTYROSINEA2AUH0.74
PTRO-PHOSPHOTYROSINEA,B,C,D,E,F,
G,H
1R1P0.74
PTRO-PHOSPHOTYROSINEA,C,D1T8I0.74
PTRO-PHOSPHOTYROSINEX2H7F0.74
PTRO-PHOSPHOTYROSINEA2ZM40.74
PTRO-PHOSPHOTYROSINEG,H,I,J,K,L2HDX0.74
PTRO-PHOSPHOTYROSINEA1QPJ0.74
PTRO-PHOSPHOTYROSINEA,B2EU00.74
PTRO-PHOSPHOTYROSINEA,C1NZV0.74
PTRO-PHOSPHOTYROSINEA,B,C,D2B4S0.74
PTRO-PHOSPHOTYROSINEB2PLD0.74
PTRO-PHOSPHOTYROSINEC,D,E,F1XXP0.74
PTRO-PHOSPHOTYROSINEA2QOQ0.74
PTRO-PHOSPHOTYROSINEA1HCT0.74
PTRO-PHOSPHOTYROSINEA,B,C,D2ZM30.74
PTRO-PHOSPHOTYROSINEB1LKK0.74
PTRO-PHOSPHOTYROSINEA,B,C,D1YVL0.74
PTRO-PHOSPHOTYROSINEB2Z8P0.74
PTRO-PHOSPHOTYROSINEA1UUR0.74
PTRO-PHOSPHOTYROSINEB,D,F,H,J,L1A810.74
PTRO-PHOSPHOTYROSINEB1LCK0.74
PTRO-PHOSPHOTYROSINEA2QO70.74
PTRO-PHOSPHOTYROSINEB1FPR0.74
PTRO-PHOSPHOTYROSINEA3BUM0.74
PTRO-PHOSPHOTYROSINEB2FCI0.74
PTRO-PHOSPHOTYROSINEA2QYQ0.74
PTRO-PHOSPHOTYROSINEA3BYM0.74
PTRO-PHOSPHOTYROSINEA2OH40.74
PTRO-PHOSPHOTYROSINEB1G1G0.74
PTRO-PHOSPHOTYROSINEB1SHC0.74
PTRO-PHOSPHOTYROSINEA1BF50.74
PTRO-PHOSPHOTYROSINEH,L1JYQ0.74
PTRO-PHOSPHOTYROSINEA2Z8C0.74
PTRO-PHOSPHOTYROSINEA,B1CM80.74
PTRO-PHOSPHOTYROSINEB,D3DA90.74
PTRO-PHOSPHOTYROSINEA,L2CIA0.74
PTRO-PHOSPHOTYROSINEX2DQ70.74
PTRO-PHOSPHOTYROSINEA,P2VIF0.74
PTRO-PHOSPHOTYROSINEB1F1W0.74
PTRO-PHOSPHOTYROSINED,E,F1SPS0.74
PTRO-PHOSPHOTYROSINEA,B2C0I0.74
PTRO-PHOSPHOTYROSINEB1OO40.74
PTRO-PHOSPHOTYROSINEA,C,D1A310.74
PTRO-PHOSPHOTYROSINEA,B,C,D,E,F,
G,H
1R1S0.74
PTRO-PHOSPHOTYROSINEA,B,C,D1NH30.74
PTRO-PHOSPHOTYROSINEB1TCE0.74
PTRO-PHOSPHOTYROSINEA,B2ETZ0.74
PTRO-PHOSPHOTYROSINEC,D1A1B0.74
PTRO-PHOSPHOTYROSINEA,B1FBV0.74
PTRO-PHOSPHOTYROSINEA1QCF0.74
PTRO-PHOSPHOTYROSINEA,B3F880.74
PTRO-PHOSPHOTYROSINEA2PTK0.74
PTRO-PHOSPHOTYROSINEA1QPD0.74
PTRO-PHOSPHOTYROSINEA,B1RRJ0.74
PTRO-PHOSPHOTYROSINEA,C,D1K4T0.74
PTRO-PHOSPHOTYROSINEA1YWN0.74
PTRO-PHOSPHOTYROSINEA,B,C,D1R1Q0.74
PTRO-PHOSPHOTYROSINEA,B,E,F1RQQ0.74
PTRO-PHOSPHOTYROSINEA3EYH0.74
PTRO-PHOSPHOTYROSINEA,B,C,D2VX30.74
PTRO-PHOSPHOTYROSINEA,B1YRK0.74
PTRO-PHOSPHOTYROSINEP1AYB0.74
PTRO-PHOSPHOTYROSINEC,D1D4W0.74
PTRO-PHOSPHOTYROSINEA1YVJ0.74
PTRO-PHOSPHOTYROSINEA,B2GQG0.74
PTRO-PHOSPHOTYROSINEA1PTV0.74
PTRO-PHOSPHOTYROSINEB1FU50.74
PTRO-PHOSPHOTYROSINEA1BG10.74
PTRO-PHOSPHOTYROSINEA2IVT0.74
PTRO-PHOSPHOTYROSINEP1J4K0.74
PTRO-PHOSPHOTYROSINEP1AOU0.74
PTRO-PHOSPHOTYROSINEA,C,D1TL80.74
PTRO-PHOSPHOTYROSINEA2DVJ0.74
PTRO-PHOSPHOTYROSINEA,B2J170.74
PTRO-PHOSPHOTYROSINEA,C3BUW0.74
PTRO-PHOSPHOTYROSINEB2PLE0.74
PTRO-PHOSPHOTYROSINEB2BBU0.74
PTRO-PHOSPHOTYROSINEC,D1M6X0.74
PTRO-PHOSPHOTYROSINEA,C1RR80.74
PTRO-PHOSPHOTYROSINEA2J0L0.74
PTRO-PHOSPHOTYROSINEB1JU50.74
PTRO-PHOSPHOTYROSINEA2H8H0.74
PTRO-PHOSPHOTYROSINEB2NMB0.74
PTRO-PHOSPHOTYROSINEC,D,H1P4E0.74
PTRO-PHOSPHOTYROSINEA,B1Z1B0.74
PTRO-PHOSPHOTYROSINEA3BU50.74
PTRO-PHOSPHOTYROSINEI1QG10.74
PTRO-PHOSPHOTYROSINEA,C1SC70.74
PTRO-PHOSPHOTYROSINEA3E620.74
PTRO-PHOSPHOTYROSINEA,C3BUX0.74
PTRO-PHOSPHOTYROSINEB2DXP0.74
PTRO-PHOSPHOTYROSINEB2Q8Y0.74
PTRO-PHOSPHOTYROSINEA,C1NZL0.74
PTRO-PHOSPHOTYROSINEA,B,C,D1YGU0.74
PTRO-PHOSPHOTYROSINEA2IVU0.74
PTRO-PHOSPHOTYROSINEA,B1U540.74
PTRO-PHOSPHOTYROSINEA,B,C,D1P130.74
PTRO-PHOSPHOTYROSINEI,J,K,L1FYR0.74
PTRO-PHOSPHOTYROSINEA,C,D1SEU0.74
PTRO-PHOSPHOTYROSINEB1SHD0.74
PTRO-PHOSPHOTYROSINEA,B3CD30.74
PTRO-PHOSPHOTYROSINEA2QOB0.74
PTRO-PHOSPHOTYROSINEB2H7E0.74
PTRO-PHOSPHOTYROSINEB1PIC0.74
PTRO-PHOSPHOTYROSINEA3EYG0.74
PTRO-PHOSPHOTYROSINEA1FMK0.74
PTRO-PHOSPHOTYROSINEA3E630.74
PTRO-PHOSPHOTYROSINEC,D1A1E0.74
PTRO-PHOSPHOTYROSINEA1QPC0.74
PTRO-PHOSPHOTYROSINEP1FHR0.74
PTRO-PHOSPHOTYROSINEB1H9O0.74
PTRO-PHOSPHOTYROSINEA,B1GAG0.74
PTRO-PHOSPHOTYROSINEB2YU70.74
PTRO-PHOSPHOTYROSINEA1HCS0.74
PTRO-PHOSPHOTYROSINEA,B,C,D3DQW0.74
PTRO-PHOSPHOTYROSINEA3BYO0.74
PTRO-PHOSPHOTYROSINEA,B1EEO0.74
PTRO-PHOSPHOTYROSINEC,D2IUI0.74
PTRO-PHOSPHOTYROSINEA,B,C,D1YGR0.74
PTRO-PHOSPHOTYROSINEB2RMX0.74
PTRO-PHOSPHOTYROSINEA,B3F7Z0.74
PTRO-PHOSPHOTYROSINEB1LCJ0.74
PTRO-PHOSPHOTYROSINEA3E640.74
PTRO-PHOSPHOTYROSINEL1BM20.74
PTRO-PHOSPHOTYROSINEB2ROR0.74
PTRO-PHOSPHOTYROSINEA,C3EB00.74
PTRO-PHOSPHOTYROSINEA2SRC0.74
PTRO-PHOSPHOTYROSINEA,B1EEN0.74
PTRO-PHOSPHOTYROSINEB1SHA0.74
PTRO-PHOSPHOTYROSINEA,B1YI60.74
PTRO-PHOSPHOTYROSINEP1K2M0.74
PTRO-PHOSPHOTYROSINEA2IVV0.74
PTRO-PHOSPHOTYROSINEB1IRS0.74
PTRO-PHOSPHOTYROSINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,R,S,T
3F5P0.74
PTRO-PHOSPHOTYROSINEA,B2ZOQ0.74
PTRO-PHOSPHOTYROSINEA,C3BUO0.74
PTRO-PHOSPHOTYROSINEA2QON0.74
PTRO-PHOSPHOTYROSINEA,B3FXX0.74
PTRO-PHOSPHOTYROSINEA1QPE0.74
PTRO-PHOSPHOTYROSINEB1MW40.74
PTRO-PHOSPHOTYROSINED1J4X0.74
PTRO-PHOSPHOTYROSINEA1K3A0.74
PTRO-PHOSPHOTYROSINEA,B2C0O0.74
PTRO-PHOSPHOTYROSINEA,B,C,D,E,F,
I,J,K,L,M,N
1X270.74
PTRO-PHOSPHOTYROSINEA,B3D440.74
PTRO-PHOSPHOTYROSINEA,B1Z190.74
PTRO-PHOSPHOTYROSINEA2OFU0.74
DOB2,4-DIHYDROXYBENZOIC ACIDA1DOD0.7
DOB2,4-DIHYDROXYBENZOIC ACIDA1DOE0.7
DOB2,4-DIHYDROXYBENZOIC ACIDA1PBB0.7
2992,6-DIFORMYL-4-METHYLPHENYL DIHYDROGEN PHOSPHATEA1O4E0.76
SAL2-HYDROXYBENZOIC ACIDA2I2Z0.73
SAL2-HYDROXYBENZOIC ACIDA,B,C1FIQ0.73
SAL2-HYDROXYBENZOIC ACIDA2I300.73
SAL2-HYDROXYBENZOIC ACIDA,B1PTH0.73
SAL2-HYDROXYBENZOIC ACIDA,B3DEU0.73
SAL2-HYDROXYBENZOIC ACIDA,B,C,D2E1Q0.73
SAL2-HYDROXYBENZOIC ACIDA,B3HGX0.73
SAL2-HYDROXYBENZOIC ACIDA,B3BPX0.73
SAL2-HYDROXYBENZOIC ACIDA1WYG0.73
SAL2-HYDROXYBENZOIC ACIDA1JGS0.73
SAL2-HYDROXYBENZOIC ACIDX1M6E0.73
SAL2-HYDROXYBENZOIC ACIDA3B9M0.73
SAL2-HYDROXYBENZOIC ACIDA,B1FO40.73
SAL2-HYDROXYBENZOIC ACIDA,B1Y7I0.73
SAL2-HYDROXYBENZOIC ACIDA,B2FN10.73
3002-FORMYL-6-METHOXYPHENYL DIHYDROGEN PHOSPHATEA1O410.76
RBE3-(BENZOYLOXY)-8-AZA-BICYCLO[3.2.1]OCTANE-
2-CARBOXYLIC ACID
H1RIU0.7
1592-HYDROXY-5-(2-MERCAPTO-ETHYLSULFAMOYL)-
BENZOIC ACID
A,B1NME0.73
HZ3dimethyl (1R,4S)-5,6-bis(4-hydroxyphenyl)-
7-oxabicyclo[2.2.1]hepta-2,5-diene-
2,3-dicarboxylate
A,B2QR90.7
219CYCLOHEXYLMETHYL 2-FORMYLPHENYL HYDROGEN PHOSPHATEA1O4I0.78
1NH(2E,6E)-8-[(3-BENZOYLBENZYL)OXY]-
3,7-DIMETHYLOCTA-2,6-DIENYL TRIHYDROGEN DIPHOSPHATE
B1O1S0.71
OBE3-(3-HYDROXY-BENZOYLOXY)-8-METHYL-
8-AZA-BICYCLO[3.2.1]OCTANE-2-CARBOXYLIC ACID
H1RIV0.7
2PB2-[(DIOXIDOPHOSPHINO)OXY]BENZOATEA1SDE0.82
AIN2-(ACETYLOXY)BENZOIC ACIDA3GCL0.77
AIN2-(ACETYLOXY)BENZOIC ACIDA2QQT0.77
AIN2-(ACETYLOXY)BENZOIC ACIDA1TGM0.77
AIN2-(ACETYLOXY)BENZOIC ACIDA2G5J0.77
AIN2-(ACETYLOXY)BENZOIC ACIDA1OXR0.77
AIN2-(ACETYLOXY)BENZOIC ACIDA3HWY0.77
AI73-(heptyloxy)benzoic acidA,B2O3Z0.72
SCLACETIC ACID SALICYLOYL-AMINO-ESTERA1EBV0.72
GRE2,6-DIHYDROXYBENZOIC ACIDA,B,C,D2DVU0.71
BZMBENZOIC ACID PHENYLMETHYLESTERA,B1DZM0.71
2622-FORMYLPHENYL DIHYDROGEN PHOSPHATEA1O4D0.78