Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01749229
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 |
HE7 | 4-{[(14beta,17alpha)-3-hydroxyestra- 1,3,5(10)-trien-17-yl]oxy}-4-oxobutanoic acid | A,B,C,D | 2Z77 | 0.72 | |
OHP | (2-HYDROXYPHENYL)ACETIC ACID | A | 2INZ | 0.71 | |
MOX | 7-METHOXY-3-METHYL-7-(3-METHYL- 2-PHENYL-BUT-3-ENOYLAMINO)-8-OXO- 5-OXA-1-AZA-BICYCLO[4.2.0]OCT-2- ENE-2-CARBOXYLIC ACID | A,B | 1I5Q | 0.72 | |
MOX | 7-METHOXY-3-METHYL-7-(3-METHYL- 2-PHENYL-BUT-3-ENOYLAMINO)-8-OXO- 5-OXA-1-AZA-BICYCLO[4.2.0]OCT-2- ENE-2-CARBOXYLIC ACID | A,B | 1FCO | 0.72 | |
R12 | 9-(4-HYDROXY-2,6-DIMETHYL-PHENYL)- 3,7-DIMETHYL-NONA-4,6,8-TRIENOIC ACID | A | 3CBS | 0.75 | |
3HP | 3-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCE | 0.71 | |
MPB | 4-HYDROXY-BENZOIC ACID METHYL ESTER | B,C,D | 2VK0 | 0.72 | |
MPB | 4-HYDROXY-BENZOIC ACID METHYL ESTER | A,B,D | 3MTH | 0.72 | |
HXS | 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol | A,B | 3CV6 | 0.71 | |
166 | 6-CARBAMIMIDOYL-2-[2-HYDROXY-6- (4-HYDROXY-PHENYL)-INDAN-1-YL]- HEXANOIC ACID | B,I | 1QJ1 | 0.74 | |
CMQ | N~2~-[(BENZYLOXY)CARBONYL]-N-[(1S,2S)- 2-HYDROXY-1-(4-HYDROXYBENZYL)PROPYL]- L-LEUCINAMIDE | A,B,C,D,E,F, G,H,I,J,K,L, M,N | 2FZS | 0.72 | |
RWF | R-WARFARIN | A,B | 2BXD | 0.73 | |
PFI | (6S)-6-CYCLOPENTYL-6-[2-(3-FLUORO- 4-ISOPROPOXYPHENYL)ETHYL]-4-HYDROXY- 5,6-DIHYDRO-2H-PYRAN-2-ONE | A | 2HAI | 0.73 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | H,I | 1A2C | 0.72 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | A,B,C | 1CA7 | 0.72 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | A,B,C,D | 3GGO | 0.72 | |
MAX | MATAIRESINOL | A | 2BGM | 0.76 | |
WRS | 4-HYDROXY-3-[(1S,3S)-3-HYDROXY- 1-PHENYLBUTYL]-2H-CHROMEN-2-ONE | A | 1HA2 | 0.73 | |
MPP | 3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID | A,B | 2AY3 | 0.73 | |
OAC | TRANS-O-HYDROXY-ALPHA-METHYL CINNAMATE | C | 3GCH | 0.73 | |
UIN | 5,6,7,8,9,10-HEXAHYDRO-4-HYDROXY- 3-(1-PHENYLPROPYL)CYCLOOCTA[B]PYRAN- 2-ONE | B | 5UPJ | 0.74 | |
BHP | (S)-5-(4-BENZYLOXY-PHENYL)-4-(7- PHENYL-HEPTANOYLAMINO)-PENTANOIC ACID | A,B | 1J1A | 0.71 | |
HZ3 | dimethyl (1R,4S)-5,6-bis(4-hydroxyphenyl)- 7-oxabicyclo[2.2.1]hepta-2,5-diene- 2,3-dicarboxylate | A,B | 2QR9 | 0.76 | |
CIO | CILOMILAST | A,B | 1XOM | 0.75 | |
CIO | CILOMILAST | A,B | 1XLX | 0.75 | |
IM3 | (2E)-3-(3,4-DIHYDROXYPHENYL)-2- IMINOPROPANOIC ACID | A,B,C,D | 2E82 | 0.71 | |
WRR | 4-HYDROXY-3-[(1S,3R)-3-HYDROXY- 1-PHENYLBUTYL]-2H-CHROMEN-2-ONE | A | 1H9Z | 0.73 | |
NLT | N-DODECANOYL-L-TYROSINE | A,B,C,D,E,F, G,H | 2G0B | 0.71 | |
HHH | (2S)-hydroxy(4-hydroxyphenyl)ethanoic acid | A,B | 2R5V | 0.71 | |
HPP | HYDROXYPHENYL PROPIONIC ACID | A,B | 2TPL | 0.74 | |
HPP | HYDROXYPHENYL PROPIONIC ACID | A,B,C,D | 3GGP | 0.74 | |
ZYA | BENZOYL-TYROSINE-ALANINE-METHYL KETONE | A | 1AIM | 0.75 | |
OEF | 3,5-DIBROMO-4-(3-ISOPROPYL-PHENOXY)BENZOIC ACID | A | 2J4A | 0.71 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2PIT | 0.71 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NQ1 | 0.71 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2PIU | 0.71 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2PKL | 0.71 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A,B | 3D57 | 0.71 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NQ2 | 0.71 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 2QPY | 0.71 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NQ0 | 0.71 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A | 1NUO | 0.71 | |
4HY | [4-(4-HYDROXY-3-IODO-PHENOXY)-3,5- DIIODO-PHENYL]-ACETIC ACID | A,B | 2PIN | 0.71 | |
BBB | 1-((2-HYDROXYETHOXY)METHYL)-5-(3- (BENZYLOXY)BENZYL)-6-HYDROXYPYRIMIDINE- 2,4(1H,3H)-DIONE | A,B,C,D,E,F | 1U1G | 0.71 | |
HDI | 3-(4-HYDROXYPHENYL)-4,5-DIHYDRO- 5-ISOXAZOLE-ACETIC ACID METHYL ESTER | A,B,C | 1LJT | 0.71 | |
MTY | META-TYROSINE | A | 2TOH | 0.7 | |
MTY | META-TYROSINE | A,B | 1BIQ | 0.7 | |
MTY | META-TYROSINE | A | 1Q7O | 0.7 | |
EQI | EQUILIN | A,B | 1EQU | 0.7 | |
4TN | (2E)-3-[3-(3-ETHOXY-5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRONAPHTHALEN-2- YL)-4-HYDROXYPHENYL]ACRYLIC ACID | A | 2P1U | 0.7 | |
G24 | [4-(3-BENZYL-4-HYDROXYBENZYL)-3,5- DIMETHYLPHENOXY]ACETIC ACID | A | 1Q4X | 0.7 | |
YOF | 3-FLUOROTYROSINE | A,B | 1XIL | 0.7 | |
YOF | 3-FLUOROTYROSINE | A,B | 1XDC | 0.7 | |
YOF | 3-FLUOROTYROSINE | A | 1RRX | 0.7 | |
YOF | 3-FLUOROTYROSINE | A,B | 3FYG | 0.7 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2B96 | 0.7 | |
ANN | 4-METHOXYBENZOIC ACID | A | 2QUE | 0.7 | |
ANN | 4-METHOXYBENZOIC ACID | A | 1SV3 | 0.7 | |
ANN | 4-METHOXYBENZOIC ACID | A | 1O2E | 0.7 | |
ANN | 4-METHOXYBENZOIC ACID | A,B,C,D | 3CBI | 0.7 | |
B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A | 3HF0 | 0.72 | |
B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A | 2OXK | 0.72 | |
B3Y | (3S)-3-AMINO-4-(4-HYDROXYPHENYL)BUTANOIC ACID | A,B,C | 2OXJ | 0.72 | |
4HP | 4-HYDROXYPHENYLACETATE | A,B,C,D | 2JBT | 0.73 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYJ | 0.73 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYM | 0.73 | |
4HP | 4-HYDROXYPHENYLACETATE | B | 1AI6 | 0.73 | |
4HP | 4-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCG | 0.73 | |
MTJ | N,O-DIMETHYL-L-TYROSINE | A,B | 1ATL | 0.72 | |
T3O | 4-[(1S,2R,5S)-4,4,8-TRIMETHYL-3- OXABICYCLO[3.3.1]NON-7-EN-2-YL]PHENOL | A,B | 2G44 | 0.71 | |
U03 | 4-HYDROXY-7-METHOXY-3-(1-PHENYL- PROPYL)-CHROMEN-2-ONE | A | 3UPJ | 0.74 | |
183 | 1-((2-HYDROXYETHOXY)METHYL)-5-(3- (BENZYLOXY)BENZYL)PYRIMIDINE-2,4(1H,3H)- DIONE | A,B,C,D,E,F | 1U1F | 0.7 | |
DTY | D-TYROSINE | A | 1C4B | 0.72 | |
DTY | D-TYROSINE | A,L | 1ZEA | 0.72 | |
DTY | D-TYROSINE | A,B,C,D,E,F, G,H | 1OF6 | 0.72 | |
DTY | D-TYROSINE | A,B | 1UNO | 0.72 | |
DTY | D-TYROSINE | A | 2IGZ | 0.72 | |
DTY | D-TYROSINE | A,B,C,H,K,L | 2R5D | 0.72 | |
DTY | D-TYROSINE | A,B | 2Q33 | 0.72 | |
DTY | D-TYROSINE | H,S | 2H9E | 0.72 | |
DTY | D-TYROSINE | A,B,C,H,K,L | 2R5B | 0.72 | |
DTY | D-TYROSINE | A | 2IH0 | 0.72 | |
DTY | D-TYROSINE | A | 1D7T | 0.72 | |
DTY | D-TYROSINE | A,B | 1XA0 | 0.72 | |
NAT | ETHYL 4-(3-HYDROXYPHENYL)-6-METHYL- 2-THIOXO-1,2,3,4-TETRAHYDROPYRIMIDINE- 5-CARBOXYLATE | A,B | 1Q0B | 0.74 | |
NAT | ETHYL 4-(3-HYDROXYPHENYL)-6-METHYL- 2-THIOXO-1,2,3,4-TETRAHYDROPYRIMIDINE- 5-CARBOXYLATE | A,B | 1X88 | 0.74 | |
167 | 6-CARBAMIMIDOYL-2-[2-HYDROXY-5- (3-METHOXY-PHENYL)-INDAN-1-YL]- HEXANOIC ACID | B,I | 1QJ6 | 0.73 | |
OX3 | 4-HYDROXYBENZALDEHYDE O-(CYCLOHEXYLCARBONYL)OXIME | A,B,C | 2OOH | 0.7 | |
C1N | N-[(BENZYLOXY)CARBONYL]LEUCYL-N~1~- [3-FLUORO-1-(4-HYDROXYBENZYL)-2- OXOPROPYL]LEUCINAMIDE | A | 1ZCM | 0.74 | |
TYB | TYROSINAL | A,B | 1KDZ | 0.7 | |
TYB | TYROSINAL | A | 1Q11 | 0.7 | |
TYB | TYROSINAL | A,B | 2J5B | 0.7 | |
TYB | TYROSINAL | A,I | 1GA4 | 0.7 | |
TYB | TYROSINAL | A,B,C | 1NLU | 0.7 | |
TYB | TYROSINAL | A,B | 1KE1 | 0.7 | |
TYB | TYROSINAL | A,B | 1H3F | 0.7 | |
TYB | TYROSINAL | A,B | 1H3E | 0.7 | |
SDN | [(3S)-9-hydroxy-1-methyl-10-oxo- 4,10-dihydro-3H-benzo[g]isochromen- 3-yl]acetic acid | A,B | 3B6C | 0.73 | |
PTM | ALPHA-METHYL-O-PHOSPHOTYROSINE | H,L | 1JYQ | 0.71 | |
AGG | TIROFIBAN | A,B | 2VDM | 0.71 | |
SGI | 3-(4-hydroxyphenyl)propanamide | A,B | 2R9K | 0.73 | |
AI7 | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.72 | |
EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2QZZ | 0.77 | |
EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2R2G | 0.77 | |
MX1 | (2R)-2-((R)-CARBOXY{[CARBOXY(4- HYDROXYPHENYL)ACETYL]AMINO}METHOXYMETHYL)- 5-METHYLENE-5,6-DIHYDRO-2H-1,3- OXAZINE-4-CARBOXYLIC ACID | A | 2AIO | 0.7 | |
NPS | (2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid | A | 2VDB | 0.72 | |
ODE | DIETHYL (1R,2S,3R,4S)-5,6-BIS(4- HYDROXYPHENYL)-7-OXABICYCLO[2.2.1]HEPT- 5-ENE-2,3-DICARBOXYLATE | A,B | 2QH6 | 0.77 | |
NIU | 6,7,8,9-TETRAHYDRO-4-HYDROXY-3- (1-PHENYLPROPYL)CYCLOHEPTA[B]PYRAN- 2-ONE | A | 6UPJ | 0.74 | |
HXP | 3,6-DIHYDROXY-XANTHENE-9-PROPIONIC ACID | A | 1XAN | 0.72 | |
SWF | S-WARFARIN | A,B | 1OG5 | 0.73 | |
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,B | 3BXS | 0.71 | |
GRR | (2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid | A | 3CDS | 0.72 | |
LRG | (2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid | A | 3B3K | 0.72 | |
LRG | (2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid | A | 3D6D | 0.72 | |
IYR | 3-IODO-TYROSINE | A | 2D98 | 0.7 | |
IYR | 3-IODO-TYROSINE | A | 2D8P | 0.7 | |
IYR | 3-IODO-TYROSINE | A,B | 3GFD | 0.7 | |
IYR | 3-IODO-TYROSINE | A | 2R1Q | 0.7 | |
IYR | 3-IODO-TYROSINE | A | 2ZP1 | 0.7 | |
IYR | 3-IODO-TYROSINE | A,B,C,D | 2ZXV | 0.7 | |
IYR | 3-IODO-TYROSINE | C | 1CF0 | 0.7 | |
IYR | 3-IODO-TYROSINE | A | 1XXZ | 0.7 | |
IYR | 3-IODO-TYROSINE | A | 2D97 | 0.7 | |
IYR | 3-IODO-TYROSINE | A | 1XY9 | 0.7 | |
IYR | 3-IODO-TYROSINE | A | 2Z10 | 0.7 | |
IYR | 3-IODO-TYROSINE | A | 1WQ3 | 0.7 | |
IYR | 3-IODO-TYROSINE | A | 2D8O | 0.7 | |
IYR | 3-IODO-TYROSINE | A | 2D8W | 0.7 | |
IYR | 3-IODO-TYROSINE | A | 2Z11 | 0.7 |