Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02392831
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
---|---|---|---|---|---|
Ligand | Ligand name | Chain | PDB | Tanimoto | Ligand in PDB |
4FE | (2E)-3-(3-hydroxy-4-methoxyphenyl)prop- 2-enoic acid | A | 3CBG | 0.88 | |
DCN | DICLOSAN | A,B,C,D | 2PD4 | 0.74 | |
D1L | 2-[4-(2,4-DICHLOROPHENOXY)PHENOXY]PROPANOIC ACID | A,B | 1UYR | 0.72 | |
V55 | 4-hydroxy-3-methoxybenzaldehyde | B,D,E,F | 2VSS | 0.76 | |
V55 | 4-hydroxy-3-methoxybenzaldehyde | A,B,D,E,F | 2VSU | 0.76 | |
HC4 | A | 1TS6 | 0.72 | ||
HC4 | A | 3PHY | 0.72 | ||
HC4 | A | 3PYP | 0.72 | ||
HC4 | A | 1T1C | 0.72 | ||
HC4 | A | 1OT6 | 0.72 | ||
HC4 | A | 1TS0 | 0.72 | ||
HC4 | A | 1T1A | 0.72 | ||
HC4 | A | 2PYP | 0.72 | ||
HC4 | A | 2ZOI | 0.72 | ||
HC4 | A | 1OTI | 0.72 | ||
HC4 | A | 1XFQ | 0.72 | ||
HC4 | A | 2D01 | 0.72 | ||
HC4 | A,B,C,D,E,F, G,H | 2O7B | 0.72 | ||
HC4 | A | 2ZOH | 0.72 | ||
HC4 | A | 1GSW | 0.72 | ||
HC4 | A | 2QJ7 | 0.72 | ||
HC4 | A | 1F9I | 0.72 | ||
HC4 | X | 1UWP | 0.72 | ||
HC4 | A | 2PHY | 0.72 | ||
HC4 | A | 1T1B | 0.72 | ||
HC4 | A | 1F98 | 0.72 | ||
HC4 | A | 1T19 | 0.72 | ||
HC4 | X | 1UWN | 0.72 | ||
HC4 | A,B,C,D,E,F, G,H | 2O7F | 0.72 | ||
HC4 | A | 1UGU | 0.72 | ||
HC4 | A | 1TS8 | 0.72 | ||
HC4 | A,B | 1OTD | 0.72 | ||
HC4 | A | 1OTE | 0.72 | ||
HC4 | A | 1GSX | 0.72 | ||
HC4 | A | 1TS7 | 0.72 | ||
HC4 | A | 2PYR | 0.72 | ||
HC4 | A | 1S4S | 0.72 | ||
HC4 | A | 1GSV | 0.72 | ||
HC4 | A | 2I9V | 0.72 | ||
HC4 | A | 2QWS | 0.72 | ||
HC4 | A | 1XFN | 0.72 | ||
HC4 | A | 1S4R | 0.72 | ||
HC4 | A | 1T18 | 0.72 | ||
HC4 | A | 1OTA | 0.72 | ||
HC4 | A | 1D7E | 0.72 | ||
HC4 | A | 1S1Z | 0.72 | ||
HC4 | A,B,C | 1MZU | 0.72 | ||
HC4 | A,B | 1ODV | 0.72 | ||
HC4 | A,B | 2J3J | 0.72 | ||
HC4 | A | 2QJ5 | 0.72 | ||
HC4 | A | 1OTB | 0.72 | ||
HC4 | A | 2D02 | 0.72 | ||
HC4 | A | 1OT9 | 0.72 | ||
HC4 | A | 1NWZ | 0.72 | ||
HC4 | A | 1S1Y | 0.72 | ||
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,C,E | 1KYZ | 0.88 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1JT2 | 0.88 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 6ATJ | 0.88 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B | 1GKL | 0.88 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1GWT | 0.88 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B,C | 2BJH | 0.88 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 1GW2 | 0.88 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 3CBG | 0.88 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 2BNJ | 0.88 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A,B | 1UWC | 0.88 | |
FER | 3-(4-HYDROXY-3-METHOXYPHENYL)-2- PROPENOIC ACID | A | 7ATJ | 0.88 | |
VXX | VANILLATE | A,B | 1WB6 | 0.78 | |
261 | 2-ethoxyphenol | X | 2RB1 | 0.7 | |
MCT | 4-METHYLCATECHOL | A | 1L4G | 0.71 | |
MCT | 4-METHYLCATECHOL | A | 2EHZ | 0.71 | |
MCT | 4-METHYLCATECHOL | A,B | 1DMH | 0.71 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D | 3E5U | 0.74 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B | 3E6B | 0.74 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D | 3E5X | 0.74 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B | 2H6B | 0.74 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | C | 3E6C | 0.74 | |
SXX | SINAPINATE | A,B | 1WB4 | 0.84 | |
JPM | 5-benzyl-2-(2,4-dichlorophenoxy)phenol | A,B,C,D | 3FNF | 0.78 | |
TOM | 4-(2-METHOXYPHENYL)-2-OXOBUT-3- ENOIC ACID | A | 2IMF | 0.75 | |
JPA | 4-(2,4-DICHLOROPHENOXY)-2'-METHYLBIPHENYL- 3-OL | A,B | 2FOI | 0.78 | |
VNL | 4-HYDROXY-3-METHOXYBENZOATE | A,B,C,D | 2AHC | 0.78 | |
VNL | 4-HYDROXY-3-METHOXYBENZOATE | A | 1XLR | 0.78 | |
BP3 | 2'-CHLORO-BIPHENYL-2,3-DIOL | A | 1LGT | 0.72 | |
CFA | (2,4-DICHLOROPHENOXY)ACETIC ACID | B,E | 2P1N | 0.73 | |
MPP | 3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID | A,B | 2AY3 | 0.78 | |
EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2QZZ | 0.76 | |
EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2R2G | 0.76 | |
AI7 | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.71 | |
JPL | 5-(cyclohexa-1,5-dien-1-ylmethyl)- 2-(2,4-dichlorophenoxy)phenol | A | 3FNG | 0.79 | |
YRG | (2S)-2-(4-chlorophenoxy)-3-phenylpropanoic acid | A | 3CDP | 0.73 | |
BP6 | 2',6'-DICHLORO-BIPHENYL-2,6-DIOL | A | 1LKD | 0.71 | |
EAA | ETHACRYNIC ACID | A,B | 3DGQ | 0.75 | |
EAA | ETHACRYNIC ACID | A,B | 11GS | 0.75 | |
EAA | ETHACRYNIC ACID | A,B,C,D | 1GSF | 0.75 | |
EAA | ETHACRYNIC ACID | A,B | 2GSS | 0.75 | |
EAA | ETHACRYNIC ACID | A,B | 3GSS | 0.75 | |
EAA | ETHACRYNIC ACID | A,B | 1GSE | 0.75 | |
DHC | CAFFEIC ACID | A,B,C,D,E,F, G,H | 2O7D | 0.79 | |
DHC | CAFFEIC ACID | A | 1KOU | 0.79 | |
KOM | 7,8-dihydroxy-4-phenyl-2H-chromen- 2-one | A | 2ZVJ | 0.73 | |
IH5 | [4-(4-HYDROXY-3-ISOPROPYLPHENOXY)- 3,5-DIMETHYLPHENYL]ACETIC ACID | A | 1NAV | 0.75 | |
IH5 | [4-(4-HYDROXY-3-ISOPROPYLPHENOXY)- 3,5-DIMETHYLPHENYL]ACETIC ACID | A | 1NAX | 0.75 | |
HFL | 5-(3,3-DIHYDROXYPROPENY)-3-METHOXY- BENZENE-1,2-DIOL | C,F | 1KYW | 0.76 | |
JPN | 2-(2,4-DICHLOROPHENOXY)-5-(3-PHENYLPROPYL)PHENOL | A,B | 2OL4 | 0.78 | |
TCT | 6-(4-CHLORO-2-HYDROXY-PHENOXY)- NAPHTHALEN-2-OL | A,B | 1NNU | 0.76 | |
8CM | 8-HYDROXYCOUMARIN | A | 2H8Z | 0.78 | |
JPJ | 2-(2,4-DICHLOROPHENOXY)-5-(2-PHENYLETHYL)PHENOL | A,B | 2OOS | 0.78 | |
JPJ | 2-(2,4-DICHLOROPHENOXY)-5-(2-PHENYLETHYL)PHENOL | A | 3FNH | 0.78 | |
3TN | (2E)-3-[4-HYDROXY-3-(3-METHOXY- 5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRONAPHTHALEN- 2-YL)PHENYL]ACRYLIC ACID | A | 2P1T | 0.71 | |
8PS | 5-OCTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B37 | 0.73 | |
34C | (3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACID | A,B | 1HT8 | 0.78 | |
MAX | MATAIRESINOL | A | 2BGM | 0.74 | |
43M | 4-CHLORO-3-METHYLPHENOL | A | 2P7A | 0.71 | |
5PP | 5-PENTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B36 | 0.73 | |
TCL | TRICLOSAN | A,B,C,D | 2PD3 | 0.75 | |
TCL | TRICLOSAN | A,B | 1P45 | 0.75 | |
TCL | TRICLOSAN | A,B,C,D,E,F | 2B35 | 0.75 | |
TCL | TRICLOSAN | A,B | 1D8A | 0.75 | |
TCL | TRICLOSAN | A,B | 1C14 | 0.75 | |
TCL | TRICLOSAN | A,B,C,D | 2QIO | 0.75 | |
TCL | TRICLOSAN | A,B | 1NHG | 0.75 | |
TCL | TRICLOSAN | A | 1D7O | 0.75 | |
TCL | TRICLOSAN | A,B,C,D | 2O2Y | 0.75 | |
TCL | TRICLOSAN | A,B | 1UH5 | 0.75 | |
TCL | TRICLOSAN | A,B | 2O2S | 0.75 | |
TCL | TRICLOSAN | A,B,C,D | 1QG6 | 0.75 | |
TCL | TRICLOSAN | A,B,C,D,E,F, G,H | 1QSG | 0.75 | |
CHB | 3-CHLORO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCH | 0.73 | |
SYR | SYRINGATE | A,B | 1WB5 | 0.75 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2B96 | 0.71 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2QUE | 0.71 | |
ANN | 4-METHOXYBENZOIC ACID | A | 1SV3 | 0.71 | |
ANN | 4-METHOXYBENZOIC ACID | A | 1O2E | 0.71 | |
ANN | 4-METHOXYBENZOIC ACID | A,B,C,D | 3CBI | 0.71 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A | 2QU9 | 0.81 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1QLU | 0.81 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1J | 0.81 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 2VAO | 0.81 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1K | 0.81 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1DZN | 0.81 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1L | 0.81 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1M | 0.81 | |
FX3 | 5-O-[(2E)-3-(4-hydroxy-3-methoxyphenyl)prop- 2-enoyl]-alpha-L-ribofuranose | A | 2VGD | 0.78 |