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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00538940

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
FINA1ZVX0.71
DGH(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W7Q0.72
DGH(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H
1W7R0.72
HV8BENZYL-2-AMINO-PARAMETHOXY-BENZYLSTATINEC1A8G0.75
ZYABENZOYL-TYROSINE-ALANINE-METHYL KETONEA1AIM0.7
DID4,4'[1,6-HEXANEDIYLBIS(OXY)]BISBENZENECARBOXIMIDAMIDEA,B,C,D1RPW0.7
LK4N-({6-[(4-CYANOBENZYL)OXY]NAPHTHALEN-
2-YL}SULFONYL)-D-GLUTAMIC ACID
A2UUP0.72
LK4N-({6-[(4-CYANOBENZYL)OXY]NAPHTHALEN-
2-YL}SULFONYL)-D-GLUTAMIC ACID
A2VTE0.72
K55(2S)-2-{4-butoxy-3-[({[2-fluoro-
4-(trifluoromethyl)phenyl]carbonyl}amino)methyl]benzyl}butanoic acid
A,B2ZNP0.72
NOQ(1R,2R)-N-(2-AMINOETHYL)-2-{[(4-
METHOXYPHENYL)SULFONYL]METHYL}CYCLOHEXANECARBOXAMIDE
A2F7D0.71
VSCA1EWO0.73
TYSO-SULFO-L-TYROSINEH,I1O2G0.72
TYSO-SULFO-L-TYROSINEI,J1AY60.72
TYSO-SULFO-L-TYROSINEB,I1QHR0.72
TYSO-SULFO-L-TYROSINEB,C1TWX0.72
TYSO-SULFO-L-TYROSINEB,D2K030.72
TYSO-SULFO-L-TYROSINEH,I1YPK0.72
TYSO-SULFO-L-TYROSINEH,I1SB10.72
TYSO-SULFO-L-TYROSINEA,B1ZGV0.72
TYSO-SULFO-L-TYROSINEB,I2C8Y0.72
TYSO-SULFO-L-TYROSINEH,I2ZGB0.72
TYSO-SULFO-L-TYROSINEH,I2ZC90.72
TYSO-SULFO-L-TYROSINED,H2JH60.72
TYSO-SULFO-L-TYROSINEH,I2ZDV0.72
TYSO-SULFO-L-TYROSINEI1VR10.72
TYSO-SULFO-L-TYROSINEA,B,I1DOJ0.72
TYSO-SULFO-L-TYROSINEH,I2BVR0.72
TYSO-SULFO-L-TYROSINEH,I,L1GHY0.72
TYSO-SULFO-L-TYROSINEH,I1T4V0.72
TYSO-SULFO-L-TYROSINEH,I1TOM0.72
TYSO-SULFO-L-TYROSINEH,I1YPE0.72
TYSO-SULFO-L-TYROSINEB,I1WAY0.72
TYSO-SULFO-L-TYROSINE2,31C4Y0.72
TYSO-SULFO-L-TYROSINEH,I2ZHF0.72
TYSO-SULFO-L-TYROSINEB,I2C8Z0.72
TYSO-SULFO-L-TYROSINEH,I1A5G0.72
TYSO-SULFO-L-TYROSINEH,I1YPL0.72
TYSO-SULFO-L-TYROSINEA,B,C,D,E,F,H2QAD0.72
TYSO-SULFO-L-TYROSINEH,I,R1B5G0.72
TYSO-SULFO-L-TYROSINEB,C1MU80.72
TYSO-SULFO-L-TYROSINEA,B1GWB0.72
TYSO-SULFO-L-TYROSINEB,I2C900.72
TYSO-SULFO-L-TYROSINEB,I1WBG0.72
TYSO-SULFO-L-TYROSINEB,I2C930.72
TYSO-SULFO-L-TYROSINEB,C1G300.72
TYSO-SULFO-L-TYROSINEB,H2UUK0.72
TYSO-SULFO-L-TYROSINEH,I3EGK0.72
TYSO-SULFO-L-TYROSINEH,I1C5N0.72
TYSO-SULFO-L-TYROSINEH,I1A610.72
TYSO-SULFO-L-TYROSINEH,I1C5L0.72
TYSO-SULFO-L-TYROSINEA,H1XM10.72
TYSO-SULFO-L-TYROSINEH,I1A2C0.72
TYSO-SULFO-L-TYROSINEH,I2BVX0.72
TYSO-SULFO-L-TYROSINEH,I2ZFF0.72
TYSO-SULFO-L-TYROSINEH,I3BIU0.72
TYSO-SULFO-L-TYROSINEB,H1D3P0.72
TYSO-SULFO-L-TYROSINEB,H1D3Q0.72
TYSO-SULFO-L-TYROSINEH,I2ZFP0.72
TYSO-SULFO-L-TYROSINEB,C,D1BA80.72
TYSO-SULFO-L-TYROSINEA,I1D6W0.72
TYSO-SULFO-L-TYROSINEH,I2ZF00.72
TYSO-SULFO-L-TYROSINEH,I2ZGX0.72
TYSO-SULFO-L-TYROSINEB,G1OOK0.72
TYSO-SULFO-L-TYROSINEH,I1AE80.72
TYSO-SULFO-L-TYROSINEH,I2ZFR0.72
TYSO-SULFO-L-TYROSINEA,H1NT10.72
TYSO-SULFO-L-TYROSINEH,I2ZFQ0.72
TYSO-SULFO-L-TYROSINEE,I1HAG0.72
TYSO-SULFO-L-TYROSINEB,I2C8X0.72
TYSO-SULFO-L-TYROSINEH,I2BXT0.72
TYSO-SULFO-L-TYROSINED,H2GDE0.72
TYSO-SULFO-L-TYROSINEH,I,R1TBZ0.72
TYSO-SULFO-L-TYROSINEH,I1BCU0.72
TYSO-SULFO-L-TYROSINEB,C1KTS0.72
TYSO-SULFO-L-TYROSINEH,I2BXU0.72
TYSO-SULFO-L-TYROSINEB,I1QJ70.72
TYSO-SULFO-L-TYROSINEH,I1K220.72
TYSO-SULFO-L-TYROSINEI,T1TMB0.72
TYSO-SULFO-L-TYROSINEH,I1AHT0.72
TYSO-SULFO-L-TYROSINEI1HGT0.72
TYSO-SULFO-L-TYROSINEB,I1QJ10.72
TYSO-SULFO-L-TYROSINEA,B1TA60.72
TYSO-SULFO-L-TYROSINEH,I1AFE0.72
TYSO-SULFO-L-TYROSINEH,I1AIX0.72
TYSO-SULFO-L-TYROSINEH,I2ZG00.72
TYSO-SULFO-L-TYROSINEC,D2PKS0.72
TYSO-SULFO-L-TYROSINEB,C1MUE0.72
TYSO-SULFO-L-TYROSINED,H2JH50.72
TYSO-SULFO-L-TYROSINEB,D2K050.72
TYSO-SULFO-L-TYROSINEB,C1MU60.72
TYSO-SULFO-L-TYROSINEA,B,C,D1G1S0.72
TYSO-SULFO-L-TYROSINEH,I1HAH0.72
TYSO-SULFO-L-TYROSINEH,I2ZI20.72
TYSO-SULFO-L-TYROSINEH,I3BIV0.72
TYSO-SULFO-L-TYROSINE2,31C4U0.72
TYSO-SULFO-L-TYROSINEA,B1NM60.72
TYSO-SULFO-L-TYROSINEA,B3C1K0.72
TYSO-SULFO-L-TYROSINEA,I1D9I0.72
TYSO-SULFO-L-TYROSINEH,I1YPG0.72
TYSO-SULFO-L-TYROSINEB,H1D4P0.72
TYSO-SULFO-L-TYROSINEH,I,J1TMU0.72
TYSO-SULFO-L-TYROSINEH,I1YPM0.72
TYSO-SULFO-L-TYROSINEB,C1BB00.72
TYSO-SULFO-L-TYROSINEA,C1P8V0.72
TYSO-SULFO-L-TYROSINEB,H2UUF0.72
TYSO-SULFO-L-TYROSINEB,C1G320.72
TYSO-SULFO-L-TYROSINEH,I1YPJ0.72
TYSO-SULFO-L-TYROSINEB,I2C8W0.72
TYSO-SULFO-L-TYROSINEI,K1H8D0.72
TYSO-SULFO-L-TYROSINEH,I1GJ40.72
TYSO-SULFO-L-TYROSINEH,I1O5G0.72
TYSO-SULFO-L-TYROSINEA2RLL0.72
TYSO-SULFO-L-TYROSINEH,I1AD80.72
TYSO-SULFO-L-TYROSINEH,I1C1U0.72
TYSO-SULFO-L-TYROSINEH,I,L1GHX0.72
TYSO-SULFO-L-TYROSINEA,B1ZRB0.72
TYSO-SULFO-L-TYROSINEA,B2BDY0.72
TYSO-SULFO-L-TYROSINEH,I2ZHE0.72
TYSO-SULFO-L-TYROSINED,H2JH00.72
TYSO-SULFO-L-TYROSINEA,B1TA20.72
TYSO-SULFO-L-TYROSINEB,H2UUJ0.72
TYSO-SULFO-L-TYROSINEA,H1JMO0.72
TYSO-SULFO-L-TYROSINEA,B1SL30.72
TYSO-SULFO-L-TYROSINEH,I2ZHQ0.72
TYSO-SULFO-L-TYROSINEH,I2ZO30.72
TYSO-SULFO-L-TYROSINE2,3,48KME0.72
TYSO-SULFO-L-TYROSINEH,I,L1C1W0.72
TYSO-SULFO-L-TYROSINEB,I1QJ60.72
TYSO-SULFO-L-TYROSINEA,B1Z710.72
TYSO-SULFO-L-TYROSINEA,B1ZGI0.72
TYSO-SULFO-L-TYROSINEH,I1C5O0.72
TYSO-SULFO-L-TYROSINEI,T3HAT0.72
TYSO-SULFO-L-TYROSINEH,I3DUX0.72
TYSO-SULFO-L-TYROSINEH,I1C1V0.72
TYSO-SULFO-L-TYROSINEH,I2ZNK0.72
TYSO-SULFO-L-TYROSINEH,I3D490.72
TYSO-SULFO-L-TYROSINEH,I1GJ50.72
TYSO-SULFO-L-TYROSINEH,I1UMA0.72
TYSO-SULFO-L-TYROSINEH,I3DT00.72
TYSO-SULFO-L-TYROSINEE,H1QBV0.72
TYSO-SULFO-L-TYROSINEI,K1H8I0.72
TYSO-SULFO-L-TYROSINEA,C,D1RZG0.72
TYSO-SULFO-L-TYROSINEH,I1AI80.72
TYSO-SULFO-L-TYROSINEH,I,J7KME0.72
TYSO-SULFO-L-TYROSINEH,I,L2PW80.72
TYSO-SULFO-L-TYROSINEH,I1A4W0.72
TYSO-SULFO-L-TYROSINEH,I1GHV0.72
TYSO-SULFO-L-TYROSINEH,I1NO90.72
TYSO-SULFO-L-TYROSINEH,I1AWF0.72
TYSO-SULFO-L-TYROSINEH,I1K210.72
TYSO-SULFO-L-TYROSINEH,I1T4U0.72
TYSO-SULFO-L-TYROSINEB,H1D3D0.72
TYSO-SULFO-L-TYROSINEB,H1D3T0.72
TYSO-SULFO-L-TYROSINEH,I1A460.72
TYSO-SULFO-L-TYROSINEH,I2ZDA0.72
TYSO-SULFO-L-TYROSINEH,I2ZHW0.72
TYSO-SULFO-L-TYROSINEB2K3U0.72
TYSO-SULFO-L-TYROSINEH,I3DHK0.72
TYSO-SULFO-L-TYROSINEB,C1KTT0.72
TYSO-SULFO-L-TYROSINEH,I2BVS0.72
TYSO-SULFO-L-TYROSINE31NY20.72
TYSO-SULFO-L-TYROSINEB,C1CA80.72
TYSO-SULFO-L-TYROSINEH,I1GHW0.72
TYSO-SULFO-L-TYROSINE2,31C4V0.72
TYSO-SULFO-L-TYROSINEH,I2ZIQ0.72
EINA1ZS00.71
PI9A,B1D4L0.72
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
Y124-{(1E)-3-OXO-3-[(2-PHENYLETHYL)AMINO]PROP-
1-EN-1-YL}-1,2-PHENYLENE DIACETATE
A2EW50.71
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,B1MTR0.72
ZHZ2-(4-METHOXYPHENYL)ACETAMIDED,H2HKR0.72
F792-(2-AMINOETHOXY)-3-ETHYL-6-{[(4-
FLUOROPHENYL)SULFONYL]AMINO}BENZOIC ACID
A2EA40.74
4BQ(2S)-2-amino-5-oxo-5-[(4-phenylmethoxyphenyl)amino]pentanoic acidA3CHQ0.7
BHP(S)-5-(4-BENZYLOXY-PHENYL)-4-(7-
PHENYL-HEPTANOYLAMINO)-PENTANOIC ACID
A,B1J1A0.76
2TN2-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)ETHANAMIDEA2OTF0.72
2TN2-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)ETHANAMIDEA2NUV0.72
2TN2-(4-(2-HYDROXY-3-(ISOPROPYLAMINO)PROPOXY)PHENYL)ETHANAMIDEA2OUB0.72
MTJN,O-DIMETHYL-L-TYROSINEA,B1ATL0.74
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,B1B6P0.72
T443,5,3',5'-TETRAIODO-L-THYRONINEX1Y0X0.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK10.75
T443,5,3',5'-TETRAIODO-L-THYRONINEC,D1ICT0.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA2RIW0.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B2ROX0.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B1IE40.75
T443,5,3',5'-TETRAIODO-L-THYRONINE1,21ETB0.75
T443,5,3',5'-TETRAIODO-L-THYRONINE1,21ETA0.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B,C1SN00.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B2CEO0.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA,B1F860.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK40.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK20.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK50.75
T443,5,3',5'-TETRAIODO-L-THYRONINEA1HK30.75
LK2N-[(6-BUTOXYNAPHTHALEN-2-YL)SULFONYL]-
D-GLUTAMIC ACID
A2JFF0.77
LKMN-({6-[(4-CYANO-2-FLUOROBENZYL)OXY]NAPHTHALEN-
2-YL}SULFONYL)-D-GLUTAMIC ACID
A2VTD0.71
SFX(3S)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-
1-amine
A3GWW0.73
AGGTIROFIBANA,B2VDM0.84
RS2N-HYDROXY-2-[4-(4-PHENOXY-BENZENESULFONYL)-
TETRAHYDRO-PYRAN-4-YL]-ACETAMIDE
A966C0.7
LIJBENZYL [(1S)-2-({(1S,2R)-1-BENZYL-
2-HYDROXY-3-[(3-METHOXYBENZYL)AMINO]PROPYL}AMINO)-
2-OXO-1-{[(1-PROPYLBUTYL)SULFONYL]METHYL}ETHYL]CARBAMATE
A,B,C2HIZ0.71
GRR(2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acidA3CDS0.71
RFX(3R)-N-methyl-3-phenyl-3-[4-(trifluoromethyl)phenoxy]propan-
1-amine
A3GWV0.73
C4MN-[(2R,3S)-3-AMINO-2-HYDROXY-4-
PHENYLBUTYL]-4-METHOXY-2,3,6-TRIMETHYLBENZENESULFONAMIDE
B,I2C930.72
LK3N-{[6-(PENTYLOXY)NAPHTHALEN-2-YL]SULFONYL}-
D-GLUTAMIC ACID
A2UUO0.77
MUUN-[(1S,2R)-1-BENZYL-3-{(CYCLOPROPYLMETHYL)[(3-
METHOXYPHENYL)SULFONYL]AMINO}-2-
HYDROXYPROPYL]-N'-METHYLSUCCINAMIDE
A,B2PSU0.71
GHP4-HYDROXYPHENYLGLYCINEA1DSR0.72
296(3R)-3-amino-2,2-difluoro-3-(4-
methoxyphenyl)propanoic acid
A,B2RJS0.81
886N-({4'-[(4-isobutyrylphenoxy)methyl]biphenyl-
4-yl}sulfonyl)-D-valine
A,B,C,D2RJP0.76
F1IN-[1-(2,6-dimethoxybenzyl)piperidin-
4-yl]-4-sulfanylbutanamide
A2ZJI0.71
HA26-[{(2S)-2-AMINO-3-[4-(BENZYLOXY)PHENYL]PROPYL}(HYDROXY)AMINO]-
6-OXOHEXANOIC ACID)
A2VJ80.77
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA1DSR0.72
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H
1W7R0.72
D4P(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L
1W7Q0.72
AZ2(2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACIDA,B1I7I0.76
AZ2(2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACIDA1I7G0.76
HBBN-{(2R)-2-HYDROXY-2-[(8S,11S)-8-
ISOPROPYL-6,9-DIOXO-2-OXA-7,10-
DIAZABICYCLO[11.2.2]HEPTADECA-1(15),13,16-
TRIEN-11-YL]ETHYL}-N-ISOPENTYLBENZENESULFONAMIDE
A,B1Z1H0.73
NBF[(2-ETHOXY-1-NAPHTHOYL)AMINO]METHYLBORONIC ACIDA1NY00.7
NBF[(2-ETHOXY-1-NAPHTHOYL)AMINO]METHYLBORONIC ACIDA,B1YMS0.7
HBH2-[(8S,11S)-11-{(1R)-1-HYDROXY-
2-[ISOPENTYL(PHENYLSULFONYL)AMINO]ETHYL}-
6,9-DIOXO-2-OXA-7,10-DIAZABICYCLO[11.2.2]HEPTADECA-
1(15),13,16-TRIEN-8-YL]ACETAMIDE
A,B1Z1R0.72
32P3-{2-[(5-AMINOPENTYL)AMINO]-2-OXOETHOXY}-
5-({[1-(4-FLUOROPHENYL)ETHYL]AMINO}CARBONYL)PHENYL PHENYLMETHANESULFONATE
A1TQF0.71
T333,3'-DEIODO-THYROXINEA,B1THA0.77
401(2S)-2-{3-[({[2-fluoro-4-(trifluoromethyl)phenyl]carbonyl}amino)methyl]-
4-methoxybenzyl}butanoic acid
A,B2ZNQ0.7
4BO(3S)-3-amino-4-oxo-4-[(4-phenylmethoxyphenyl)amino]butanoic acidA3CHP0.7
MZ9N-[(1S,2R)-1-BENZYL-2-HYDROXY-3-
{[(4-METHOXYPHENYL)SULFONYL][(2S)-
2-METHYLBUTYL]AMINO}PROPYL]-4-OXOHEXANAMIDE
A,B2QI70.73
SHP(4-HYDROXYMALTOSEPHENYL)GLYCINEA1DSR0.75
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,B1B6M0.72
247(3R)-3-amino-2,2-difluoro-3-(4-
hydroxyphenyl)propanoic acid
A,B2QVE0.73
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA3HF00.71
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA2OXK0.71
B3Y(3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACIDA,B,C2OXJ0.71
MBSA,B1HY70.78
DCH3-(7-DIAMINOMETHYL-NAPHTHALEN-2-
YL)-PROPIONIC ACID ETHYL ESTER
H1UVU0.73
DPDA,B1QIW0.7
DPDA1QIV0.7
LK1N-[(6-BUTOXYNAPHTHALEN-2-YL)SULFONYL]-
L-GLUTAMIC ACID
A2JFH0.77
DRRA,B3BXR0.76
ZHH2-(4-METHOXYPHENYL)ETHANAMINED,H2HKR0.7
FLTFLUOROMALONYL TYROSINEI1BZH0.73
PZM1-(4-METHOXYPHENYL)METHANAMINEA,D,H2HJB0.72