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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03400616

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
AGGTIROFIBANA,B2VDM0.72
RS2N-HYDROXY-2-[4-(4-PHENOXY-BENZENESULFONYL)-
TETRAHYDRO-PYRAN-4-YL]-ACETAMIDE
A966C0.75
DID4,4'[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDAMIDEA,B,C,D1RPW0.7
DRRA,B3BXR0.74
DRS(9S,12S)-9-(1-methylethyl)-7,10-
dioxo-2-oxa-8,11-diazabicyclo[12.2.2]octadeca-
1(16),14,17-triene-12-carboxylic acid
A,B3BXS0.74
SAG(S)-(+)-2-[4-(FLUOROBENZYLOXY-BENZYLAMINO)PROPIONAMIDE]A,B2V5Z0.7
0EZtert-butyl [(1S,2S)-1-benzyl-2-
hydroxy-3-{[(8S,11R)-8-[(1R)-1-
methylpropyl]-7,10-dioxo-2-oxa-
6,9-diazabicyclo[11.2.2]heptadeca-
1(15),13,16-trien-11-yl]amino}propyl]carbamate
A,B1MTR0.7
HQQ5-METHYL-5-(4-PHENOXY-PHENYL)-PYRIMIDINE-
2,4,6-TRIONE
A,B,C1G4K0.74
TF3N-(2-AMINOETHYL)-2-{3-CHLORO-4-
[(4-ISOPROPYLBENZYL)OXY]PHENYL} ACETAMIDE
A2BU70.7
4BR2-(4-METHYLPHENOXY)ETHYLPHOSPHINATEA1PE70.7
MTJN,O-DIMETHYL-L-TYROSINEA,B1ATL0.74
AZ2(2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACIDA,B1I7I0.73
AZ2(2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACIDA1I7G0.73
HA26-[{(2S)-2-AMINO-3-[4-(BENZYLOXY)PHENYL]PROPYL}(HYDROXY)AMINO]-
6-OXOHEXANOIC ACID)
A2VJ80.78
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A2PIT0.71
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A1NQ10.71
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A2PIU0.71
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A2PKL0.71
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A,B3D570.71
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A1NQ20.71
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A2QPY0.71
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A1NQ00.71
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A1NUO0.71
4HY[4-(4-HYDROXY-3-IODO-PHENOXY)-3,5-
DIIODO-PHENYL]-ACETIC ACID
A,B2PIN0.71
34C(3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACIDA,B1HT80.71
T443,5,3',5'-TETRAIODO-L-THYRONINEX1Y0X0.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK10.72
T443,5,3',5'-TETRAIODO-L-THYRONINEC,D1ICT0.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA2RIW0.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B2ROX0.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B1IE40.72
T443,5,3',5'-TETRAIODO-L-THYRONINE1,21ETB0.72
T443,5,3',5'-TETRAIODO-L-THYRONINE1,21ETA0.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B,C1SN00.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B2CEO0.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B1F860.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK40.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK20.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK50.72
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK30.72
TYSO-SULFO-L-TYROSINEH,I1O2G0.74
TYSO-SULFO-L-TYROSINEI,J1AY60.74
TYSO-SULFO-L-TYROSINEB,I1QHR0.74
TYSO-SULFO-L-TYROSINEB,C1TWX0.74
TYSO-SULFO-L-TYROSINEB,D2K030.74
TYSO-SULFO-L-TYROSINEH,I1YPK0.74
TYSO-SULFO-L-TYROSINEH,I1SB10.74
TYSO-SULFO-L-TYROSINEA,B1ZGV0.74
TYSO-SULFO-L-TYROSINEB,I2C8Y0.74
TYSO-SULFO-L-TYROSINEH,I2ZGB0.74
TYSO-SULFO-L-TYROSINEH,I2ZC90.74
TYSO-SULFO-L-TYROSINED,H2JH60.74
TYSO-SULFO-L-TYROSINEH,I2ZDV0.74
TYSO-SULFO-L-TYROSINEI1VR10.74
TYSO-SULFO-L-TYROSINEA,B,I1DOJ0.74
TYSO-SULFO-L-TYROSINEH,I2BVR0.74
TYSO-SULFO-L-TYROSINEH,I,L1GHY0.74
TYSO-SULFO-L-TYROSINEH,I1T4V0.74
TYSO-SULFO-L-TYROSINEH,I1TOM0.74
TYSO-SULFO-L-TYROSINEH,I1YPE0.74
TYSO-SULFO-L-TYROSINEB,I1WAY0.74
TYSO-SULFO-L-TYROSINE2,31C4Y0.74
TYSO-SULFO-L-TYROSINEH,I2ZHF0.74
TYSO-SULFO-L-TYROSINEB,I2C8Z0.74
TYSO-SULFO-L-TYROSINEH,I1A5G0.74
TYSO-SULFO-L-TYROSINEH,I1YPL0.74
TYSO-SULFO-L-TYROSINEA,B,C,D,E,F,H2QAD0.74
TYSO-SULFO-L-TYROSINEH,I,R1B5G0.74
TYSO-SULFO-L-TYROSINEB,C1MU80.74
TYSO-SULFO-L-TYROSINEA,B1GWB0.74
TYSO-SULFO-L-TYROSINEB,I2C900.74
TYSO-SULFO-L-TYROSINEB,I1WBG0.74
TYSO-SULFO-L-TYROSINEB,I2C930.74
TYSO-SULFO-L-TYROSINEB,C1G300.74
TYSO-SULFO-L-TYROSINEB,H2UUK0.74
TYSO-SULFO-L-TYROSINEH,I3EGK0.74
TYSO-SULFO-L-TYROSINEH,I1C5N0.74
TYSO-SULFO-L-TYROSINEH,I1A610.74
TYSO-SULFO-L-TYROSINEH,I1C5L0.74
TYSO-SULFO-L-TYROSINEA,H1XM10.74
TYSO-SULFO-L-TYROSINEH,I1A2C0.74
TYSO-SULFO-L-TYROSINEH,I2BVX0.74
TYSO-SULFO-L-TYROSINEH,I2ZFF0.74
TYSO-SULFO-L-TYROSINEH,I3BIU0.74
TYSO-SULFO-L-TYROSINEB,H1D3P0.74
TYSO-SULFO-L-TYROSINEB,H1D3Q0.74
TYSO-SULFO-L-TYROSINEH,I2ZFP0.74
TYSO-SULFO-L-TYROSINEB,C,D1BA80.74
TYSO-SULFO-L-TYROSINEA,I1D6W0.74
TYSO-SULFO-L-TYROSINEH,I2ZF00.74
TYSO-SULFO-L-TYROSINEH,I2ZGX0.74
TYSO-SULFO-L-TYROSINEB,G1OOK0.74
TYSO-SULFO-L-TYROSINEH,I1AE80.74
TYSO-SULFO-L-TYROSINEH,I2ZFR0.74
TYSO-SULFO-L-TYROSINEA,H1NT10.74
TYSO-SULFO-L-TYROSINEH,I2ZFQ0.74
TYSO-SULFO-L-TYROSINEE,I1HAG0.74
TYSO-SULFO-L-TYROSINEB,I2C8X0.74
TYSO-SULFO-L-TYROSINEH,I2BXT0.74
TYSO-SULFO-L-TYROSINED,H2GDE0.74
TYSO-SULFO-L-TYROSINEH,I,R1TBZ0.74
TYSO-SULFO-L-TYROSINEH,I1BCU0.74
TYSO-SULFO-L-TYROSINEB,C1KTS0.74
TYSO-SULFO-L-TYROSINEH,I2BXU0.74
TYSO-SULFO-L-TYROSINEB,I1QJ70.74
TYSO-SULFO-L-TYROSINEH,I1K220.74
TYSO-SULFO-L-TYROSINEI,T1TMB0.74
TYSO-SULFO-L-TYROSINEH,I1AHT0.74
TYSO-SULFO-L-TYROSINEI1HGT0.74
TYSO-SULFO-L-TYROSINEB,I1QJ10.74
TYSO-SULFO-L-TYROSINEA,B1TA60.74
TYSO-SULFO-L-TYROSINEH,I1AFE0.74
TYSO-SULFO-L-TYROSINEH,I1AIX0.74
TYSO-SULFO-L-TYROSINEH,I2ZG00.74
TYSO-SULFO-L-TYROSINEC,D2PKS0.74
TYSO-SULFO-L-TYROSINEB,C1MUE0.74
TYSO-SULFO-L-TYROSINED,H2JH50.74
TYSO-SULFO-L-TYROSINEB,D2K050.74
TYSO-SULFO-L-TYROSINEB,C1MU60.74
TYSO-SULFO-L-TYROSINEA,B,C,D1G1S0.74
TYSO-SULFO-L-TYROSINEH,I1HAH0.74
TYSO-SULFO-L-TYROSINEH,I2ZI20.74
TYSO-SULFO-L-TYROSINEH,I3BIV0.74
TYSO-SULFO-L-TYROSINE2,31C4U0.74
TYSO-SULFO-L-TYROSINEA,B1NM60.74
TYSO-SULFO-L-TYROSINEA,B3C1K0.74
TYSO-SULFO-L-TYROSINEA,I1D9I0.74
TYSO-SULFO-L-TYROSINEH,I1YPG0.74
TYSO-SULFO-L-TYROSINEB,H1D4P0.74
TYSO-SULFO-L-TYROSINEH,I,J1TMU0.74
TYSO-SULFO-L-TYROSINEH,I1YPM0.74
TYSO-SULFO-L-TYROSINEB,C1BB00.74
TYSO-SULFO-L-TYROSINEA,C1P8V0.74
TYSO-SULFO-L-TYROSINEB,H2UUF0.74
TYSO-SULFO-L-TYROSINEB,C1G320.74
TYSO-SULFO-L-TYROSINEH,I1YPJ0.74
TYSO-SULFO-L-TYROSINEB,I2C8W0.74
TYSO-SULFO-L-TYROSINEI,K1H8D0.74
TYSO-SULFO-L-TYROSINEH,I1GJ40.74
TYSO-SULFO-L-TYROSINEH,I1O5G0.74
TYSO-SULFO-L-TYROSINEA2RLL0.74
TYSO-SULFO-L-TYROSINEH,I1AD80.74
TYSO-SULFO-L-TYROSINEH,I1C1U0.74
TYSO-SULFO-L-TYROSINEH,I,L1GHX0.74
TYSO-SULFO-L-TYROSINEA,B1ZRB0.74
TYSO-SULFO-L-TYROSINEA,B2BDY0.74
TYSO-SULFO-L-TYROSINEH,I2ZHE0.74
TYSO-SULFO-L-TYROSINED,H2JH00.74
TYSO-SULFO-L-TYROSINEA,B1TA20.74
TYSO-SULFO-L-TYROSINEB,H2UUJ0.74
TYSO-SULFO-L-TYROSINEA,H1JMO0.74
TYSO-SULFO-L-TYROSINEA,B1SL30.74
TYSO-SULFO-L-TYROSINEH,I2ZHQ0.74
TYSO-SULFO-L-TYROSINEH,I2ZO30.74
TYSO-SULFO-L-TYROSINE2,3,48KME0.74
TYSO-SULFO-L-TYROSINEH,I,L1C1W0.74
TYSO-SULFO-L-TYROSINEB,I1QJ60.74
TYSO-SULFO-L-TYROSINEA,B1Z710.74
TYSO-SULFO-L-TYROSINEA,B1ZGI0.74
TYSO-SULFO-L-TYROSINEH,I1C5O0.74
TYSO-SULFO-L-TYROSINEI,T3HAT0.74
TYSO-SULFO-L-TYROSINEH,I3DUX0.74
TYSO-SULFO-L-TYROSINEH,I1C1V0.74
TYSO-SULFO-L-TYROSINEH,I2ZNK0.74
TYSO-SULFO-L-TYROSINEH,I3D490.74
TYSO-SULFO-L-TYROSINEH,I1GJ50.74
TYSO-SULFO-L-TYROSINEH,I1UMA0.74
TYSO-SULFO-L-TYROSINEH,I3DT00.74
TYSO-SULFO-L-TYROSINEE,H1QBV0.74
TYSO-SULFO-L-TYROSINEI,K1H8I0.74
TYSO-SULFO-L-TYROSINEA,C,D1RZG0.74
TYSO-SULFO-L-TYROSINEH,I1AI80.74
TYSO-SULFO-L-TYROSINEH,I,J7KME0.74
TYSO-SULFO-L-TYROSINEH,I,L2PW80.74
TYSO-SULFO-L-TYROSINEH,I1A4W0.74
TYSO-SULFO-L-TYROSINEH,I1GHV0.74
TYSO-SULFO-L-TYROSINEH,I1NO90.74
TYSO-SULFO-L-TYROSINEH,I1AWF0.74
TYSO-SULFO-L-TYROSINEH,I1K210.74
TYSO-SULFO-L-TYROSINEH,I1T4U0.74
TYSO-SULFO-L-TYROSINEB,H1D3D0.74
TYSO-SULFO-L-TYROSINEB,H1D3T0.74
TYSO-SULFO-L-TYROSINEH,I1A460.74
TYSO-SULFO-L-TYROSINEH,I2ZDA0.74
TYSO-SULFO-L-TYROSINEH,I2ZHW0.74
TYSO-SULFO-L-TYROSINEB2K3U0.74
TYSO-SULFO-L-TYROSINEH,I3DHK0.74
TYSO-SULFO-L-TYROSINEB,C1KTT0.74
TYSO-SULFO-L-TYROSINEH,I2BVS0.74
TYSO-SULFO-L-TYROSINE31NY20.74
TYSO-SULFO-L-TYROSINEB,C1CA80.74
TYSO-SULFO-L-TYROSINEH,I1GHW0.74
TYSO-SULFO-L-TYROSINE2,31C4V0.74
TYSO-SULFO-L-TYROSINEH,I2ZIQ0.74
MPP3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACIDA,B2AY30.72
6676-OXO-8,9,10,11-TETRAHYDRO-7H-CYCLOHEPTA[C][1]BENZOPYRAN-
3-O-SULFAMATE
A1TTM0.7
CBP2-{4-[4-(4-CHLORO-PHENOXY)-BENZENESULFONYL]-
TETRAHYDRO-PYRAN-4-YL}-N-HYDROXY-
ACETAMIDE
A,B456C0.7
CBP2-{4-[4-(4-CHLORO-PHENOXY)-BENZENESULFONYL]-
TETRAHYDRO-PYRAN-4-YL}-N-HYDROXY-
ACETAMIDE
A,B1CXV0.7
TON2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOLA,B1SEZ0.7
294N-hydroxy-4-({4-[4-(trifluoromethyl)phenoxy]phenyl}sulfonyl)tetrahydro-
2H-pyran-4-carboxamide
A,B3B8Z0.74
SGI3-(4-hydroxyphenyl)propanamideA,B2R9K0.76
PI7N-[3-(8-SEC-BUTYL-7,10-DIOXO-2-
OXA-6,9-DIAZA-BICYCLO[11.2.2] HEPTADECA-
1(16),13(17),14-TRIEN-11-YAMINO)-
2-HYDROXY-1-(4-HYDROXY-BENZYL) -
PROPYL]-3-METHYL-2-PROPIONYLAMINO-
BUTYRAMIDE
A,B1B6P0.71
HTAN-[3-(N'-HYDROXYCARBOXAMIDO)-2-
(2-METHYLPROPYL)-PROPANOYL]-O-TYROSINE-
N-METHYLAMIDE
A1FBL0.78
GRR(2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acidA3CDS0.73
RFX(3R)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-
1-amine
A3GWV0.71
ZHZ2-(4-METHOXYPHENYL)ACETAMIDED,H2HKR0.88
TYBTYROSINALA,B1KDZ0.72
TYBTYROSINALA1Q110.72
TYBTYROSINALA,B2J5B0.72
TYBTYROSINALA,I1GA40.72
TYBTYROSINALA,B,C1NLU0.72
TYBTYROSINALA,B1KE10.72
TYBTYROSINALA,B1H3F0.72
TYBTYROSINALA,B1H3E0.72
505(2R)-1-(2,6-dimethylphenoxy)propan-
2-amine
A2VIN0.71
SB82-(3-BENZOYLPHENOXY)ETHYL(HYDROXY)FORMAMIDEA2AIA0.73
SFX(3S)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-
1-amine
A3GWW0.71
PZM1-(4-METHOXYPHENYL)METHANAMINEA,D,H2HJB0.73
C61(2R,4S,5S,7S)-5-AMINO-N-BUTYL-4-
HYDROXY-7-[4-METHOXY-3-(3-METHOXYPROPOXY)BENZYL]-
2,8-DIMETHYLNONANAMIDE
C,O2V100.71
NBF[(2-ETHOXY-1-NAPHTHOYL)AMINO]METHYLBORONIC ACIDA1NY00.72
NBF[(2-ETHOXY-1-NAPHTHOYL)AMINO]METHYLBORONIC ACIDA,B1YMS0.72
FIL(1E)-1-[3-(CYCLOPENTYLOXY)-4-METHOXYPHENYL]ETHANONE O-
(AMINOCARBONYL)OXIME
A,B1XLZ0.71
TRTFRAGMENT OF TRITON X-100A,E2I0U0.71
TRTFRAGMENT OF TRITON X-100A,B1OIZ0.71
3MB3-METHOXYBENZAMIDEA3PAX0.78
JT63-[(4'-cyanobiphenyl-4-yl)oxy]-
N-hydroxypropanamide
A2JT60.76
ZHH2-(4-METHOXYPHENYL)ETHANAMINED,H2HKR0.77
BHP(S)-5-(4-BENZYLOXY-PHENYL)-4-(7-
PHENYL-HEPTANOYLAMINO)-PENTANOIC ACID
A,B1J1A0.74
TYCL-TYROSINAMIDEA2BF90.72
TYCL-TYROSINAMIDEA2OCI0.72
296(3R)-3-amino-2,2-difluoro-3-(4-
methoxyphenyl)propanoic acid
A,B2RJS0.72
AI73-(heptyloxy)benzoic acidA,B2O3Z0.72
ROLROLIPRAMA,B,C,D1OYN0.72
ROLROLIPRAMA,B1XMY0.72
ROLROLIPRAMA,B,C,D1Q9M0.72
ROLROLIPRAMA,B1RO60.72
ROLROLIPRAMA,B1XN00.72
ROLROLIPRAMA,B1TBB0.72
2TN2-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)ETHANAMIDEA2OTF0.8
2TN2-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)ETHANAMIDEA2NUV0.8
2TN2-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)ETHANAMIDEA2OUB0.8
PI6[1-BENZYL-3-(8-SEC-BUTYL-7,10-DIOXO-
2-OXA-6,9-DIAZA-BICYCLO[11.2.2] HEPTADECA-
1(16),13(17),14-TRIEN-11-YLAMINO)-
2-HYDROXY-PROPYL] -CARBAMIC ACID TERT-
BUTYL ESTER
A,B1B6M0.7
FLTFLUOROMALONYL TYROSINEI1BZH0.73
T333,3'-DEIODO-THYROXINEA,B1THA0.73
4SR(4S)-4-[3-(CYCLOPENTYLOXY)-4-METHOXYPHENYL]PYRROLIDIN-
2-ONE
A,B1XN00.72