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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02813210

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2PB2-[(DIOXIDOPHOSPHINO)OXY]BENZOATEA1SDE0.72
BJP(1R)-2-PHENYLACETAMIDO-2-(3-CARBOXYPHENYL)ETHYL BORONIC ACIDA1ERO0.74
JUG5-hydroxynaphthalene-1,4-dioneA,B,C,D,E,F3B7J0.71
34D3,5-DIHYDROXYBENZOATEA,B2BX70.7
PTMALPHA-METHYL-O-PHOSPHOTYROSINEH,L1JYQ0.77
ADL(1,8-DIHYDROXY-9-OXO-9,10-DIHYDRO-
ANTHRACEN-2-YL)-ACETIC ACID
A,B1N5S0.75
BJH1(R)-1-ACETAMIDO-2-(3-CARBOXY-2-
HYDROXYPHENYL)ETHYL BORONIC ACID
A1ERQ0.74
OAL(1,8-DIHYDROXY-9,10-DIOXO-9,10-
DIHYDRO-ANTHRACEN-2-YL)-ACETIC ACID
B1N5T0.75
1666-CARBAMIMIDOYL-2-[2-HYDROXY-6-
(4-HYDROXY-PHENYL)-INDAN-1-YL]-
HEXANOIC ACID
B,I1QJ10.74
2013-AMIDO-5-BIPHENYL-BENZOIC ACIDA2B0M0.73
1BA4-HYDROXY-N'-(4-ISOPROPYLBENZYL)BENZOHYDRAZIDEA2GPP0.72
HOP(1S,2S,5S)2-(4-GLUTARIDYLBENZYL)-
5-PHENYL-1-CYCLOHEXANOL
H,L1D6V0.7
HOP(1S,2S,5S)2-(4-GLUTARIDYLBENZYL)-
5-PHENYL-1-CYCLOHEXANOL
A,B,H,L1AXS0.7
PTHCE1-METHYLENE-HYDROXY-PHOSPHOTYROSINEC,D1A090.76
PTHCE1-METHYLENE-HYDROXY-PHOSPHOTYROSINEC,D1A1A0.76
DB12,3-DIHYDROXYBENZAMIDEA,B,C1X710.74
DBEbis(4-hydroxyphenyl)methanoneA2VKU0.71
DTYD-TYROSINEA1C4B0.71
DTYD-TYROSINEA,L1ZEA0.71
DTYD-TYROSINEA,B,C,D,E,F,
G,H
1OF60.71
DTYD-TYROSINEA,B1UNO0.71
DTYD-TYROSINEA2IGZ0.71
DTYD-TYROSINEA,B,C,H,K,L2R5D0.71
DTYD-TYROSINEA,B2Q330.71
DTYD-TYROSINEH,S2H9E0.71
DTYD-TYROSINEA,B,C,H,K,L2R5B0.71
DTYD-TYROSINEA2IH00.71
DTYD-TYROSINEA1D7T0.71
DTYD-TYROSINEA,B1XA00.71
DBS2-(2,3-DIHYDROXY-BENZOYLAMINO)-
3-HYDROXY-PROPIONIC ACID
A,B,C1L6M0.71
DBS2-(2,3-DIHYDROXY-BENZOYLAMINO)-
3-HYDROXY-PROPIONIC ACID
A,B,C3CBC0.71
DBS2-(2,3-DIHYDROXY-BENZOYLAMINO)-
3-HYDROXY-PROPIONIC ACID
A,B,C3BY00.71
MCG(S)-(ALPHA)-METHYL-4-CARBOXYPHENYLGLYCINEA,B1ISS0.72
IFBN-[(2',4'-DIFLUORO-4-HYDROXY-5-
IODOBIPHENYL-3-YL)CARBONYL]-BETA-
ALANINE
A,B3FCB0.74
SHASALICYLHYDROXAMIC ACIDX1V0H0.73
SHASALICYLHYDROXAMIC ACIDA2QPK0.73
SHASALICYLHYDROXAMIC ACIDA3FNL0.73
SHASALICYLHYDROXAMIC ACIDA3GCJ0.73
SHASALICYLHYDROXAMIC ACIDA1CK60.73
PTC2-METHYLCARBAMOYL-3-(4-PHOSPHONOOXY-
PHENYL)-CYCLOPROPANECARBOXYLIC ACID
C,D1IS00.74
1676-CARBAMIMIDOYL-2-[2-HYDROXY-5-
(3-METHOXY-PHENYL)-INDAN-1-YL]-
HEXANOIC ACID
B,I1QJ60.71
3HA3-HYDROXYANTHRANILIC ACIDA,B1U1W0.7
3HA3-HYDROXYANTHRANILIC ACIDA1YFY0.7
HBD4-HYDROXYBENZAMIDEB,C,D1BEN0.71
1FL5-(2,4-DIFLUOROPHENYL)-2-HYDROXY-
BENZOIC ACID
A,B2BXE0.73
1FL5-(2,4-DIFLUOROPHENYL)-2-HYDROXY-
BENZOIC ACID
A,B3D2T0.73
DBH2,3-DIHYDROXY-BENZOIC ACIDA,B,C3CMP0.71
DBH2,3-DIHYDROXY-BENZOIC ACIDA1MD90.71
DBH2,3-DIHYDROXY-BENZOIC ACIDA1MDB0.71
DBH2,3-DIHYDROXY-BENZOIC ACIDA,B,C1L6M0.71
DBH2,3-DIHYDROXY-BENZOIC ACIDA,B,C3BY00.71
PTRO-PHOSPHOTYROSINEP1AYC0.75
PTRO-PHOSPHOTYROSINEB1G1F0.75
PTRO-PHOSPHOTYROSINEA,C2CJM0.75
PTRO-PHOSPHOTYROSINEA2PVF0.75
PTRO-PHOSPHOTYROSINEA,B1KC20.75
PTRO-PHOSPHOTYROSINEA2CJZ0.75
PTRO-PHOSPHOTYROSINEA,B2HMH0.75
PTRO-PHOSPHOTYROSINEB1SHB0.75
PTRO-PHOSPHOTYROSINEA,B,C,D1K4S0.75
PTRO-PHOSPHOTYROSINEA,B3DK70.75
PTRO-PHOSPHOTYROSINEB,D,P2HWL0.75
PTRO-PHOSPHOTYROSINEA,B2W1I0.75
PTRO-PHOSPHOTYROSINEA,B1P7D0.75
PTRO-PHOSPHOTYROSINEE,I1ZFP0.75
PTRO-PHOSPHOTYROSINEA,B3BU60.75
PTRO-PHOSPHOTYROSINEC,D1A070.75
PTRO-PHOSPHOTYROSINEA3BU30.75
PTRO-PHOSPHOTYROSINEA,B2V7A0.75
PTRO-PHOSPHOTYROSINEB1CSY0.75
PTRO-PHOSPHOTYROSINEA3LCK0.75
PTRO-PHOSPHOTYROSINEI1TZE0.75
PTRO-PHOSPHOTYROSINEB1I3Z0.75
PTRO-PHOSPHOTYROSINEA,G3CI50.75
PTRO-PHOSPHOTYROSINEA,B1YVH0.75
PTRO-PHOSPHOTYROSINEA,B2HCK0.75
PTRO-PHOSPHOTYROSINEA3BUN0.75
PTRO-PHOSPHOTYROSINEA,B2B7A0.75
PTRO-PHOSPHOTYROSINEA,B1GNG0.75
PTRO-PHOSPHOTYROSINEA,B2OQ10.75
PTRO-PHOSPHOTYROSINEA1IR30.75
PTRO-PHOSPHOTYROSINEB1CSZ0.75
PTRO-PHOSPHOTYROSINEB1PTT0.75
PTRO-PHOSPHOTYROSINEB1KA60.75
PTRO-PHOSPHOTYROSINEC,D1A1C0.75
PTRO-PHOSPHOTYROSINEB1LKL0.75
PTRO-PHOSPHOTYROSINEA1UUS0.75
PTRO-PHOSPHOTYROSINEA,B1AD50.75
PTRO-PHOSPHOTYROSINEA1O9U0.75
PTRO-PHOSPHOTYROSINEA,B3DK60.75
PTRO-PHOSPHOTYROSINEA,B2I6O0.75
PTRO-PHOSPHOTYROSINEA1PTY0.75
PTRO-PHOSPHOTYROSINEA,B1TRN0.75
PTRO-PHOSPHOTYROSINEB1M0V0.75
PTRO-PHOSPHOTYROSINEB2G350.75
PTRO-PHOSPHOTYROSINEA,B3D420.75
PTRO-PHOSPHOTYROSINEA,B2C0T0.75
PTRO-PHOSPHOTYROSINEA,B2CBL0.75
PTRO-PHOSPHOTYROSINEA1KSW0.75
PTRO-PHOSPHOTYROSINEA,B2OW30.75
PTRO-PHOSPHOTYROSINEB1PTU0.75
PTRO-PHOSPHOTYROSINEA2ZM10.75
PTRO-PHOSPHOTYROSINEB,C2H5K0.75
PTRO-PHOSPHOTYROSINEA,B1PKG0.75
PTRO-PHOSPHOTYROSINEA3C7Q0.75
PTRO-PHOSPHOTYROSINEB2H7D0.75
PTRO-PHOSPHOTYROSINEP,Q1AYA0.75
PTRO-PHOSPHOTYROSINEA2ZYB0.75
PTRO-PHOSPHOTYROSINEL,M2CI90.75
PTRO-PHOSPHOTYROSINEI1BMB0.75
PTRO-PHOSPHOTYROSINEP1AOT0.75
PTRO-PHOSPHOTYROSINEA2ERK0.75
PTRO-PHOSPHOTYROSINEB2IUH0.75
PTRO-PHOSPHOTYROSINEB1G1H0.75
PTRO-PHOSPHOTYROSINEA,B3FUP0.75
PTRO-PHOSPHOTYROSINEL1JYR0.75
PTRO-PHOSPHOTYROSINEA3CLY0.75
PTRO-PHOSPHOTYROSINEA2AUH0.75
PTRO-PHOSPHOTYROSINEA,B,C,D,E,F,
G,H
1R1P0.75
PTRO-PHOSPHOTYROSINEA,C,D1T8I0.75
PTRO-PHOSPHOTYROSINEX2H7F0.75
PTRO-PHOSPHOTYROSINEA2ZM40.75
PTRO-PHOSPHOTYROSINEG,H,I,J,K,L2HDX0.75
PTRO-PHOSPHOTYROSINEA1QPJ0.75
PTRO-PHOSPHOTYROSINEA,B2EU00.75
PTRO-PHOSPHOTYROSINEA,C1NZV0.75
PTRO-PHOSPHOTYROSINEA,B,C,D2B4S0.75
PTRO-PHOSPHOTYROSINEB2PLD0.75
PTRO-PHOSPHOTYROSINEC,D,E,F1XXP0.75
PTRO-PHOSPHOTYROSINEA2QOQ0.75
PTRO-PHOSPHOTYROSINEA1HCT0.75
PTRO-PHOSPHOTYROSINEA,B,C,D2ZM30.75
PTRO-PHOSPHOTYROSINEB1LKK0.75
PTRO-PHOSPHOTYROSINEA,B,C,D1YVL0.75
PTRO-PHOSPHOTYROSINEB2Z8P0.75
PTRO-PHOSPHOTYROSINEA1UUR0.75
PTRO-PHOSPHOTYROSINEB,D,F,H,J,L1A810.75
PTRO-PHOSPHOTYROSINEB1LCK0.75
PTRO-PHOSPHOTYROSINEA2QO70.75
PTRO-PHOSPHOTYROSINEB1FPR0.75
PTRO-PHOSPHOTYROSINEA3BUM0.75
PTRO-PHOSPHOTYROSINEB2FCI0.75
PTRO-PHOSPHOTYROSINEA2QYQ0.75
PTRO-PHOSPHOTYROSINEA3BYM0.75
PTRO-PHOSPHOTYROSINEA2OH40.75
PTRO-PHOSPHOTYROSINEB1G1G0.75
PTRO-PHOSPHOTYROSINEB1SHC0.75
PTRO-PHOSPHOTYROSINEA1BF50.75
PTRO-PHOSPHOTYROSINEH,L1JYQ0.75
PTRO-PHOSPHOTYROSINEA2Z8C0.75
PTRO-PHOSPHOTYROSINEA,B1CM80.75
PTRO-PHOSPHOTYROSINEB,D3DA90.75
PTRO-PHOSPHOTYROSINEA,L2CIA0.75
PTRO-PHOSPHOTYROSINEX2DQ70.75
PTRO-PHOSPHOTYROSINEA,P2VIF0.75
PTRO-PHOSPHOTYROSINEB1F1W0.75
PTRO-PHOSPHOTYROSINED,E,F1SPS0.75
PTRO-PHOSPHOTYROSINEA,B2C0I0.75
PTRO-PHOSPHOTYROSINEB1OO40.75
PTRO-PHOSPHOTYROSINEA,C,D1A310.75
PTRO-PHOSPHOTYROSINEA,B,C,D,E,F,
G,H
1R1S0.75
PTRO-PHOSPHOTYROSINEA,B,C,D1NH30.75
PTRO-PHOSPHOTYROSINEB1TCE0.75
PTRO-PHOSPHOTYROSINEA,B2ETZ0.75
PTRO-PHOSPHOTYROSINEC,D1A1B0.75
PTRO-PHOSPHOTYROSINEA,B1FBV0.75
PTRO-PHOSPHOTYROSINEA1QCF0.75
PTRO-PHOSPHOTYROSINEA,B3F880.75
PTRO-PHOSPHOTYROSINEA2PTK0.75
PTRO-PHOSPHOTYROSINEA1QPD0.75
PTRO-PHOSPHOTYROSINEA,B1RRJ0.75
PTRO-PHOSPHOTYROSINEA,C,D1K4T0.75
PTRO-PHOSPHOTYROSINEA1YWN0.75
PTRO-PHOSPHOTYROSINEA,B,C,D1R1Q0.75
PTRO-PHOSPHOTYROSINEA,B,E,F1RQQ0.75
PTRO-PHOSPHOTYROSINEA3EYH0.75
PTRO-PHOSPHOTYROSINEA,B,C,D2VX30.75
PTRO-PHOSPHOTYROSINEA,B1YRK0.75
PTRO-PHOSPHOTYROSINEP1AYB0.75
PTRO-PHOSPHOTYROSINEC,D1D4W0.75
PTRO-PHOSPHOTYROSINEA1YVJ0.75
PTRO-PHOSPHOTYROSINEA,B2GQG0.75
PTRO-PHOSPHOTYROSINEA1PTV0.75
PTRO-PHOSPHOTYROSINEB1FU50.75
PTRO-PHOSPHOTYROSINEA1BG10.75
PTRO-PHOSPHOTYROSINEA2IVT0.75
PTRO-PHOSPHOTYROSINEP1J4K0.75
PTRO-PHOSPHOTYROSINEP1AOU0.75
PTRO-PHOSPHOTYROSINEA,C,D1TL80.75
PTRO-PHOSPHOTYROSINEA2DVJ0.75
PTRO-PHOSPHOTYROSINEA,B2J170.75
PTRO-PHOSPHOTYROSINEA,C3BUW0.75
PTRO-PHOSPHOTYROSINEB2PLE0.75
PTRO-PHOSPHOTYROSINEB2BBU0.75
PTRO-PHOSPHOTYROSINEC,D1M6X0.75
PTRO-PHOSPHOTYROSINEA,C1RR80.75
PTRO-PHOSPHOTYROSINEA2J0L0.75
PTRO-PHOSPHOTYROSINEB1JU50.75
PTRO-PHOSPHOTYROSINEA2H8H0.75
PTRO-PHOSPHOTYROSINEB2NMB0.75
PTRO-PHOSPHOTYROSINEC,D,H1P4E0.75
PTRO-PHOSPHOTYROSINEA,B1Z1B0.75
PTRO-PHOSPHOTYROSINEA3BU50.75
PTRO-PHOSPHOTYROSINEI1QG10.75
PTRO-PHOSPHOTYROSINEA,C1SC70.75
PTRO-PHOSPHOTYROSINEA3E620.75
PTRO-PHOSPHOTYROSINEA,C3BUX0.75
PTRO-PHOSPHOTYROSINEB2DXP0.75
PTRO-PHOSPHOTYROSINEB2Q8Y0.75
PTRO-PHOSPHOTYROSINEA,C1NZL0.75
PTRO-PHOSPHOTYROSINEA,B,C,D1YGU0.75
PTRO-PHOSPHOTYROSINEA2IVU0.75
PTRO-PHOSPHOTYROSINEA,B1U540.75
PTRO-PHOSPHOTYROSINEA,B,C,D1P130.75
PTRO-PHOSPHOTYROSINEI,J,K,L1FYR0.75
PTRO-PHOSPHOTYROSINEA,C,D1SEU0.75
PTRO-PHOSPHOTYROSINEB1SHD0.75
PTRO-PHOSPHOTYROSINEA,B3CD30.75
PTRO-PHOSPHOTYROSINEA2QOB0.75
PTRO-PHOSPHOTYROSINEB2H7E0.75
PTRO-PHOSPHOTYROSINEB1PIC0.75
PTRO-PHOSPHOTYROSINEA3EYG0.75
PTRO-PHOSPHOTYROSINEA1FMK0.75
PTRO-PHOSPHOTYROSINEA3E630.75
PTRO-PHOSPHOTYROSINEC,D1A1E0.75
PTRO-PHOSPHOTYROSINEA1QPC0.75
PTRO-PHOSPHOTYROSINEP1FHR0.75
PTRO-PHOSPHOTYROSINEB1H9O0.75
PTRO-PHOSPHOTYROSINEA,B1GAG0.75
PTRO-PHOSPHOTYROSINEB2YU70.75
PTRO-PHOSPHOTYROSINEA1HCS0.75
PTRO-PHOSPHOTYROSINEA,B,C,D3DQW0.75
PTRO-PHOSPHOTYROSINEA3BYO0.75
PTRO-PHOSPHOTYROSINEA,B1EEO0.75
PTRO-PHOSPHOTYROSINEC,D2IUI0.75
PTRO-PHOSPHOTYROSINEA,B,C,D1YGR0.75
PTRO-PHOSPHOTYROSINEB2RMX0.75
PTRO-PHOSPHOTYROSINEA,B3F7Z0.75
PTRO-PHOSPHOTYROSINEB1LCJ0.75
PTRO-PHOSPHOTYROSINEA3E640.75
PTRO-PHOSPHOTYROSINEL1BM20.75
PTRO-PHOSPHOTYROSINEB2ROR0.75
PTRO-PHOSPHOTYROSINEA,C3EB00.75
PTRO-PHOSPHOTYROSINEA2SRC0.75
PTRO-PHOSPHOTYROSINEA,B1EEN0.75
PTRO-PHOSPHOTYROSINEB1SHA0.75
PTRO-PHOSPHOTYROSINEA,B1YI60.75
PTRO-PHOSPHOTYROSINEP1K2M0.75
PTRO-PHOSPHOTYROSINEA2IVV0.75
PTRO-PHOSPHOTYROSINEB1IRS0.75
PTRO-PHOSPHOTYROSINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,R,S,T
3F5P0.75
PTRO-PHOSPHOTYROSINEA,B2ZOQ0.75
PTRO-PHOSPHOTYROSINEA,C3BUO0.75
PTRO-PHOSPHOTYROSINEA2QON0.75
PTRO-PHOSPHOTYROSINEA,B3FXX0.75
PTRO-PHOSPHOTYROSINEA1QPE0.75
PTRO-PHOSPHOTYROSINEB1MW40.75
PTRO-PHOSPHOTYROSINED1J4X0.75
PTRO-PHOSPHOTYROSINEA1K3A0.75
PTRO-PHOSPHOTYROSINEA,B2C0O0.75
PTRO-PHOSPHOTYROSINEA,B,C,D,E,F,
I,J,K,L,M,N
1X270.75
PTRO-PHOSPHOTYROSINEA,B3D440.75
PTRO-PHOSPHOTYROSINEA,B1Z190.75
PTRO-PHOSPHOTYROSINEA2OFU0.75
AI73-(heptyloxy)benzoic acidA,B2O3Z0.71
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA3HF00.72
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA2OXK0.72
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA,B,C2OXJ0.72
3HB3-HYDROXYBENZOIC ACIDM,N,O,P,Q,R3PCB0.73
3HB3-HYDROXYBENZOIC ACIDA2DKH0.73
ARYARYLOMYCIN A2A,B1T7D0.7
5PH5-[5-(1-CARBOXYMETHYL-2-OXO-PROPYLCARBAMOYL)-
5-PHENYL-PENTYLSULFAMOYL]-2-HYDROXY-
BENZOIC ACID
A1RWV0.7
2992,6-DIFORMYL-4-METHYLPHENYL DIHYDROGEN PHOSPHATEA1O4E0.71
ECAN,N',N''-[BENZENE-1,3,5-TRIYLTRIS(METHYLENE)]TRIS(2,3-
DIHYDROXYBENZAMIDE)
A,B2CHU0.7
219CYCLOHEXYLMETHYL 2-FORMYLPHENYL HYDROGEN PHOSPHATEA1O4I0.77
EB4N,N',N''-[(3S,7S,11S)-2,6,10-trioxo-
1,5,9-trioxacyclododecane-3,7,11-
triyl]tris(2,3-dihydroxybenzamide)
A,B,C3CMP0.71
AKV{3-[(1R,3S)-1,3-DIHYDROXYPENTYL]-
4,5,9,10-TETRAHYDROXY-2-ANTHRYL}ACETATE
A,B,C,D2F990.71
864(2S)-2-[3-(AMINOMETHYL)PHENYL]-
3-[(R)-[(1R)-1-{[(BENZYLOXY)CARBONYL]AMINO}-
2-METHYLPROPYL](HYDROXY)PHOSPHORYL]PROPANOIC ACID
A,B,C2PJ20.7
PSNBENZYL 2-FORMYLPHENYL HYDROGEN PHOSPHATEA1O4K0.76
FHIA,B1Y1D0.7
HZ3dimethyl (1R,4S)-5,6-bis(4-hydroxyphenyl)-
7-oxabicyclo[2.2.1]hepta-2,5-diene-
2,3-dicarboxylate
A,B2QR90.7
SGI3-(4-hydroxyphenyl)propanamideA,B2R9K0.73
687N-ACETYL-N-[1-(1,1'-BIPHENYL-4-
YLMETHYL)-2-OXOAZEPAN-3-YL]-3-FORMYL-
O-PHOSPHONOTYROSINAMIDE
A1O450.7
2622-FORMYLPHENYL DIHYDROGEN PHOSPHATEA1O4D0.72
BIK3,7-DIHYDROXY-2-NAPHTHOIC ACIDA1U5A0.73
BIK3,7-DIHYDROXY-2-NAPHTHOIC ACIDA1U5C0.73
3XH3-Hydroxyhippuric acidA3E9K0.71
IFAA,B3FC80.74
MTYMETA-TYROSINEA2TOH0.71
MTYMETA-TYROSINEA,B1BIQ0.71
MTYMETA-TYROSINEA1Q7O0.71
ODEDIETHYL (1R,2S,3R,4S)-5,6-BIS(4-
HYDROXYPHENYL)-7-OXABICYCLO[2.2.1]HEPT-
5-ENE-2,3-DICARBOXYLATE
A,B2QH60.72
BJI1(R)-1-ACETAMIDO-2-(3-CARBOXYPHENYL)ETHYL BORONIC ACIDA1ERM0.7
SDN[(3S)-9-hydroxy-1-methyl-10-oxo-
4,10-dihydro-3H-benzo[g]isochromen-
3-yl]acetic acid
A,B3B6C0.7
SCLACETIC ACID SALICYLOYL-AMINO-ESTERA1EBV0.77
OBE3-(3-HYDROXY-BENZOYLOXY)-8-METHYL-
8-AZA-BICYCLO[3.2.1]OCTANE-2-CARBOXYLIC ACID
H1RIV0.72