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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02600906

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DHCCAFFEIC ACIDA,B,C,D,E,F,
G,H
2O7D0.7
DHCCAFFEIC ACIDA1KOU0.7
AC6P-HYDROXYACETOPHENONEA2GQ80.7
AC6P-HYDROXYACETOPHENONEX2O480.7
SAF3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOLA1GQR0.71
SAF3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOLA1GQS0.71
AEF4-(2-aminoethyl)phenolA3BRA0.71
SGI3-(4-hydroxyphenyl)propanamideA,B2R9K0.71
4MP1-(4-METHOXYBENZOYL)-2-PYRROLIDINONEA,B2AL50.71
HC4A1TS60.75
HC4A3PHY0.75
HC4A3PYP0.75
HC4A1T1C0.75
HC4A1OT60.75
HC4A1TS00.75
HC4A1T1A0.75
HC4A2PYP0.75
HC4A2ZOI0.75
HC4A1OTI0.75
HC4A1XFQ0.75
HC4A2D010.75
HC4A,B,C,D,E,F,
G,H
2O7B0.75
HC4A2ZOH0.75
HC4A1GSW0.75
HC4A2QJ70.75
HC4A1F9I0.75
HC4X1UWP0.75
HC4A2PHY0.75
HC4A1T1B0.75
HC4A1F980.75
HC4A1T190.75
HC4X1UWN0.75
HC4A,B,C,D,E,F,
G,H
2O7F0.75
HC4A1UGU0.75
HC4A1TS80.75
HC4A,B1OTD0.75
HC4A1OTE0.75
HC4A1GSX0.75
HC4A1TS70.75
HC4A2PYR0.75
HC4A1S4S0.75
HC4A1GSV0.75
HC4A2I9V0.75
HC4A2QWS0.75
HC4A1XFN0.75
HC4A1S4R0.75
HC4A1T180.75
HC4A1OTA0.75
HC4A1D7E0.75
HC4A1S1Z0.75
HC4A,B,C1MZU0.75
HC4A,B1ODV0.75
HC4A,B2J3J0.75
HC4A2QJ50.75
HC4A1OTB0.75
HC4A2D020.75
HC4A1OT90.75
HC4A1NWZ0.75
HC4A1S1Y0.75
F165-(3-HYDROXYPHENYL)ISOTHIAZOL-3(2H)-
ONE 1,1-DIOXIDE
A2CM80.75
Y13(2E)-3-(3,4-DIHYDROXYPHENYL)-N-
[2-(4-HYDROXYPHENYL)ETHYL]ACRYLAMIDE
A2EW60.73
CH6{(4Z)-2-[(1S)-1-amino-3-(methylsulfanyl)propyl]-
4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A2H5Q0.7
CH6{(4Z)-2-[(1S)-1-amino-3-(methylsulfanyl)propyl]-
4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A1XQM0.7
CH6{(4Z)-2-[(1S)-1-amino-3-(methylsulfanyl)propyl]-
4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A,B2QLG0.7
CH6{(4Z)-2-[(1S)-1-amino-3-(methylsulfanyl)propyl]-
4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A1XA90.7
PCRP-CRESOLA1JHV0.72
PCRP-CRESOLA1JHU0.72
PCRP-CRESOLA,B,C,D1DIQ0.72
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQJ0.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQ30.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQL0.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DPZ0.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQO0.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQ90.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQ40.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQF0.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQ60.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQC0.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQD0.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A1F090.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DPW0.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQ10.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQ50.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A1F0B0.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQK0.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A1MYW0.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQN0.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A2YFP0.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQ80.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DPX0.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQE0.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQI0.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQ70.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQU0.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A,B,C,D2DD90.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQ20.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQH0.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQA0.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3DQM0.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A,B2DD70.71
CR2{(4Z)-2-(aminomethyl)-4-[(4-hydroxyphenyl)methylidene]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A,B,C,D,E,F2G3O0.71
ETY4-ethylphenolA,B,C,D2RA60.72
2HC(2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACIDA,B1V5Z0.73
CQR[(4Z)-2-(AMINOMETHYL)-4-(4-HYDROXYBENZYLIDENE)-
5-OXO-4,5-DIHYDRO-1H-IMIDAZOL-1-
YL]ACETIC ACID
A,B,C,D2G6Y0.71
CQR[(4Z)-2-(AMINOMETHYL)-4-(4-HYDROXYBENZYLIDENE)-
5-OXO-4,5-DIHYDRO-1H-IMIDAZOL-1-
YL]ACETIC ACID
A,B,C,D2G6X0.71
SD2N-(SULFANYLACETYL)TYROSYLPROLYLMETHIONINAMIDEA,B1PWQ0.73
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
B,D2A540.71
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3E5V0.71
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
B,D2A560.71
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
B,D2A530.71
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
B,D2A500.71
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A,B,G,H3CFH0.71
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A,B,C,D3E5W0.71
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A,B,C,D,E,F,
G,H
3BXC0.71
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A,B,G,H3CFF0.71
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A3E5T0.71
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A,B,C,D,E,F,
G,H
3BXB0.71
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
B,D2A520.71
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A,B2QLG0.71
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A,B3BXA0.71
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A,B,C,D,E,F,
G,H
2V4E0.71
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A,B2QLI0.71
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A,B1UIS0.71
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A,B,C,D,E,F,
G,H
1ZGQ0.71
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A,B,G,H3CFA0.71
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A,B2QLH0.71
NRQ{(4Z)-4-(4-hydroxybenzylidene)-
2-[3-(methylthio)propanimidoyl]-
5-oxo-4,5-dihydro-1H-imidazol-1-
yl}acetic acid
A,B3BX90.71
AEG4-[(2R)-2-aminopropyl]phenolA3BUF0.7
FHC2-FLUORO-3-(4-HYDROXYPHENYL)-2E-
PROPENEOATE
A2OPA0.73
FHC2-FLUORO-3-(4-HYDROXYPHENYL)-2E-
PROPENEOATE
A,B,C1MFI0.73
FHC2-FLUORO-3-(4-HYDROXYPHENYL)-2E-
PROPENEOATE
A,B1GYY0.73
XYG[(4Z)-2-[(1Z)-ETHANIMIDOYL]-4-(4-
HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO-
1H-IMIDAZOL-1-YL]ACETIC ACID
A,B2PXW0.71
XYG[(4Z)-2-[(1Z)-ETHANIMIDOYL]-4-(4-
HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO-
1H-IMIDAZOL-1-YL]ACETIC ACID
A,B,C,D2FL10.71
XYG[(4Z)-2-[(1Z)-ETHANIMIDOYL]-4-(4-
HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO-
1H-IMIDAZOL-1-YL]ACETIC ACID
A,B2PXS0.71
XYG[(4Z)-2-[(1Z)-ETHANIMIDOYL]-4-(4-
HYDROXYBENZYLIDENE)-5-OXO-4,5-DIHYDRO-
1H-IMIDAZOL-1-YL]ACETIC ACID
A,B,C,D2ICR0.71