Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03135177
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 |
TBT | 8,9,10,11-TETRAHYDRO-BENZO[A]ANTHRACENE- 8,9,10-TRIOL | A | 1DJD | 0.72 | |
ENM | (5S,8R,9S,10S,13R,14S,17S)-13-{2- [(3,5-DIFLUOROBENZYL)OXY]ETHYL}- 17-HYDROXY-10-METHYLHEXADECAHYDRO- 3H-CYCLOPENTA[A]PHENANTHREN-3-ONE | A | 2PNU | 0.72 | |
U03 | 4-HYDROXY-7-METHOXY-3-(1-PHENYL- PROPYL)-CHROMEN-2-ONE | A | 3UPJ | 0.7 | |
IBP | IBUPROFEN | A | 3FKX | 0.73 | |
IBP | IBUPROFEN | A,B | 2BXG | 0.73 | |
IBP | IBUPROFEN | A,B | 1EQG | 0.73 | |
IBP | IBUPROFEN | A,B,C | 2WD9 | 0.73 | |
IBP | IBUPROFEN | A | 2PWS | 0.73 | |
BE7 | (4-CARBOXYPHENYL)(CHLORO)MERCURY | A | 1ZFK | 0.73 | |
BE7 | (4-CARBOXYPHENYL)(CHLORO)MERCURY | A | 1ZFQ | 0.73 | |
BE7 | (4-CARBOXYPHENYL)(CHLORO)MERCURY | A | 1Z9Y | 0.73 | |
BE7 | (4-CARBOXYPHENYL)(CHLORO)MERCURY | A | 1ZH9 | 0.73 | |
BE7 | (4-CARBOXYPHENYL)(CHLORO)MERCURY | A | 1ZGE | 0.73 | |
BE7 | (4-CARBOXYPHENYL)(CHLORO)MERCURY | A | 1ZGF | 0.73 | |
G24 | [4-(3-BENZYL-4-HYDROXYBENZYL)-3,5- DIMETHYLPHENOXY]ACETIC ACID | A | 1Q4X | 0.73 | |
TMM | 1,3,5-BENZENETRICARBOXYLIC ACID | A,B,C,D | 1SDL | 0.73 | |
TMM | 1,3,5-BENZENETRICARBOXYLIC ACID | A,B,C,D | 1SDK | 0.73 | |
BM6 | 4-[2-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTHALEN-2-YL)-[1,3]DIOXOLAN- 2-YL]-BENZOIC ACID | A | 1MVC | 0.84 | |
BM6 | 4-[2-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTHALEN-2-YL)-[1,3]DIOXOLAN- 2-YL]-BENZOIC ACID | A,C,E,G | 1MZN | 0.84 | |
NDD | 2,6-DICARBOXYNAPHTHALENE | A | 1U4O | 0.81 | |
NDD | 2,6-DICARBOXYNAPHTHALENE | A,B,C,D | 1HAC | 0.81 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | 0,1,3,4,5,9, A,B,C,H,J,K, L,M,N,O,Q,R, S,T,U,Y,Z | 1VQ6 | 0.73 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | A,B | 1C1X | 0.73 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | 0,1,3,4,9,A, B,C,D,F,H,J, K,L,M,N,O,Q, R,S,T,U,Y,Z | 1VQP | 0.73 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | 0,1,2,3,4,5, 9,A,B,C,D,F, H,J,K,L,M,N, O,Q,R,S,T,U, Y,Z | 1VQN | 0.73 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1QRP | 0.73 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | A | 2CTC | 0.73 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1E82 | 0.73 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1E81 | 0.73 | |
OPH | 2-HYDROXY-3-PHENYL-PROPIONIC ACID METHYL ESTER | E,I | 1PPM | 0.76 | |
OPH | 2-HYDROXY-3-PHENYL-PROPIONIC ACID METHYL ESTER | E,I | 1PPL | 0.76 | |
OST | METHYL (2Z)-3-METHOXY-2-{2-[(E)- 2-PHENYLVINYL]PHENYL}ACRYLATE | C,D,E | 1SQQ | 0.78 | |
HGB | 4-(HYDROXYMERCURY)BENZOIC ACID | A | 1F2W | 0.74 | |
HGB | 4-(HYDROXYMERCURY)BENZOIC ACID | A | 2F14 | 0.74 | |
HGB | 4-(HYDROXYMERCURY)BENZOIC ACID | A | 1BV3 | 0.74 | |
HGB | 4-(HYDROXYMERCURY)BENZOIC ACID | A | 2AW1 | 0.74 | |
HGB | 4-(HYDROXYMERCURY)BENZOIC ACID | A | 1ZE8 | 0.74 | |
DXB | 1,2-HYDRO-1-OXY-3,4-HYDRO-3-(1- METHOXY-2-OXY-3,4-DIHYDROXYPENTYL)- 8,9-DIHYDROXY-7-METHYL-ANTHRACENE | A,B | 1BP8 | 0.72 | |
HTQ | HOMOTROPINE | A,B,C | 2DQZ | 0.71 | |
HTQ | HOMOTROPINE | A,B,C,D,E,F | 1MX5 | 0.71 | |
26C | A,B | 2F7I | 0.8 | ||
DBE | bis(4-hydroxyphenyl)methanone | A | 2VKU | 0.71 | |
AZ2 | (2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACID | A,B | 1I7I | 0.72 | |
AZ2 | (2S)-2-ETHOXY-3-[4-(2-{4-[(METHYLSULFONYL)OXY]PHENYL}ETHOXY)PHENYL]PROPANOIC ACID | A | 1I7G | 0.72 | |
YR3 | (2S)-3-{4-[1-ethyl-1-(4-{[(2R)- 2-hydroxy-3,3-dimethylbutyl]oxy}- 3-methylphenyl)propyl]-2-methylphenoxy}propane- 1,2-diol | A | 2ZFX | 0.71 | |
WRS | 4-HYDROXY-3-[(1S,3S)-3-HYDROXY- 1-PHENYLBUTYL]-2H-CHROMEN-2-ONE | A | 1HA2 | 0.73 | |
4FC | A | 1YSG | 0.81 | ||
PYP | 2'-DEOXYRIBOFURANOSYLPYRENE-5'- MONOPHOSPHATE | A,B | 1FZS | 0.71 | |
PYP | 2'-DEOXYRIBOFURANOSYLPYRENE-5'- MONOPHOSPHATE | A,B | 1FZL | 0.71 | |
WRR | 4-HYDROXY-3-[(1S,3R)-3-HYDROXY- 1-PHENYLBUTYL]-2H-CHROMEN-2-ONE | A | 1H9Z | 0.73 | |
BEZ | BENZOIC ACID | A,B | 2F8D | 0.74 | |
BEZ | BENZOIC ACID | A,B | 1A8U | 0.74 | |
BEZ | BENZOIC ACID | A,B | 1REE | 0.74 | |
BEZ | BENZOIC ACID | A | 1L7Q | 0.74 | |
BEZ | BENZOIC ACID | A | 1I69 | 0.74 | |
BEZ | BENZOIC ACID | H,L | 1RUL | 0.74 | |
BEZ | BENZOIC ACID | A,B | 3CCF | 0.74 | |
BEZ | BENZOIC ACID | A | 1W9Q | 0.74 | |
BEZ | BENZOIC ACID | A,B,G,J | 2DU8 | 0.74 | |
BEZ | BENZOIC ACID | H,L | 1RUA | 0.74 | |
BEZ | BENZOIC ACID | A,B,C,D,E,F, G,H | 1H4O | 0.74 | |
BEZ | BENZOIC ACID | H,L | 1RU9 | 0.74 | |
BEZ | BENZOIC ACID | A,B,C,D | 2V32 | 0.74 | |
BEZ | BENZOIC ACID | A | 2QMQ | 0.74 | |
BEZ | BENZOIC ACID | A | 1UKB | 0.74 | |
BEZ | BENZOIC ACID | A,B | 1RED | 0.74 | |
BEZ | BENZOIC ACID | A,B | 1OC3 | 0.74 | |
BEZ | BENZOIC ACID | A,B | 1REF | 0.74 | |
BEZ | BENZOIC ACID | A,B | 2O02 | 0.74 | |
BEZ | BENZOIC ACID | A,B | 2VJ1 | 0.74 | |
BEZ | BENZOIC ACID | A,B,C | 1WSP | 0.74 | |
BEZ | BENZOIC ACID | A | 1HZ4 | 0.74 | |
BEZ | BENZOIC ACID | A | 2Q38 | 0.74 | |
BEZ | BENZOIC ACID | A,B,C,D | 1UUJ | 0.74 | |
BEZ | BENZOIC ACID | A,B | 2QL8 | 0.74 | |
BEZ | BENZOIC ACID | A | 2Q0I | 0.74 | |
BEZ | BENZOIC ACID | A,B | 1S8F | 0.74 | |
BEZ | BENZOIC ACID | D,E,F,G,H | 1DJR | 0.74 | |
BEZ | BENZOIC ACID | A,B,C,D,E,F, G,H,I | 1ONI | 0.74 | |
BEZ | BENZOIC ACID | A,B,C,D | 1I7Q | 0.74 | |
BEZ | BENZOIC ACID | A,B,C,D | 2RHM | 0.74 | |
BEZ | BENZOIC ACID | A,B | 2F78 | 0.74 | |
BEZ | BENZOIC ACID | A,B | 2VL2 | 0.74 | |
BEZ | BENZOIC ACID | A | 1HD2 | 0.74 | |
BEZ | BENZOIC ACID | A | 1JU4 | 0.74 | |
BEZ | BENZOIC ACID | H,L | 2AJY | 0.74 | |
BEZ | BENZOIC ACID | A,B,C | 3GV1 | 0.74 | |
BEZ | BENZOIC ACID | A | 2Q6U | 0.74 | |
BEZ | BENZOIC ACID | A,B | 1VE9 | 0.74 | |
BEZ | BENZOIC ACID | A,B | 1S9A | 0.74 | |
BEZ | BENZOIC ACID | H,L,M | 1OP3 | 0.74 | |
BEZ | BENZOIC ACID | A | 1W9E | 0.74 | |
BEZ | BENZOIC ACID | A,B,C,D | 2V2G | 0.74 | |
BEZ | BENZOIC ACID | H,L | 2AK1 | 0.74 | |
BEZ | BENZOIC ACID | A,B,C,D,E,F, G,H | 2V41 | 0.74 | |
BEZ | BENZOIC ACID | A,B | 1GYX | 0.74 | |
BEZ | BENZOIC ACID | A | 1V1T | 0.74 | |
BEZ | BENZOIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1YAJ | 0.74 | |
BEZ | BENZOIC ACID | A,B | 1HKQ | 0.74 | |
BEZ | BENZOIC ACID | H,L | 1RUK | 0.74 | |
BEZ | BENZOIC ACID | A | 2Q1B | 0.74 | |
BEZ | BENZOIC ACID | H,L | 1RUM | 0.74 | |
BEZ | BENZOIC ACID | A,B | 2F7A | 0.74 | |
BEZ | BENZOIC ACID | A,B,C,D,E,F, G,H | 1KIF | 0.74 | |
BEZ | BENZOIC ACID | A,B | 2V7B | 0.74 | |
BEZ | BENZOIC ACID | H | 1NCW | 0.74 | |
BEZ | BENZOIC ACID | A,B | 1TMX | 0.74 | |
BEZ | BENZOIC ACID | A | 1URM | 0.74 | |
BEZ | BENZOIC ACID | A | 1W9O | 0.74 | |
BEZ | BENZOIC ACID | A,B,C,D | 1GXS | 0.74 | |
BEZ | BENZOIC ACID | H | 1RUP | 0.74 | |
BEZ | BENZOIC ACID | A,B,C,D | 1KQB | 0.74 | |
BEZ | BENZOIC ACID | A | 2Q9R | 0.74 | |
BEZ | BENZOIC ACID | D,H | 2OK6 | 0.74 | |
BEZ | BENZOIC ACID | A,B | 2Q0J | 0.74 | |
1FL | 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID | A,B | 2BXE | 0.72 | |
1FL | 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID | A,B | 3D2T | 0.72 | |
1NH | (2E,6E)-8-[(3-BENZOYLBENZYL)OXY]- 3,7-DIMETHYLOCTA-2,6-DIENYL TRIHYDROGEN DIPHOSPHATE | B | 1O1S | 0.78 | |
DXA | 1,2-HYDRO-1-OXY-3,4-HYDRO-3-(1- METHOXY-2-OXY-3,4-DIHYDROXYPENTYL)- 8,9-DIHYDROXY-7-(SEC-BUTYL)-ANTHRACENE | A,B | 1CP8 | 0.72 | |
HHH | (2S)-hydroxy(4-hydroxyphenyl)ethanoic acid | A,B | 2R5V | 0.71 | |
173 | BENZOYL-FORMIC ACID | A,B | 1SZE | 0.7 | |
RWF | R-WARFARIN | A,B | 2BXD | 0.7 | |
2DM | 2-HYDROXY-3-(PYREN-1-YLMETHOXY)PROPYL DIHYDROGEN PHOSPHATE | A,B | 1S88 | 0.73 | |
FBC | A,B | 2B9A | 0.8 | ||
254 | 6-[HYDROXYIMINO-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTALEN-2- YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID | A | 1FD0 | 0.73 | |
LRG | (2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid | A | 3B3K | 0.76 | |
LRG | (2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid | A | 3D6D | 0.76 | |
2E3 | (2E)-3-[4-hydroxy-3-(3,5,5,8,8- pentamethyl-5,6,7,8-tetrahydronaphthalen- 2-yl)phenyl]prop-2-enoic acid | A | 3FUG | 0.71 | |
HC7 | (2S)-2-[4'-({dimethyl[2-(phosphonooxy)ethyl]ammonio}acetyl)biphenyl- 4-yl]-2-hydroxy-4,4-dimethylmorpholin- 4-ium | A | 3FEG | 0.7 | |
R12 | 9-(4-HYDROXY-2,6-DIMETHYL-PHENYL)- 3,7-DIMETHYL-NONA-4,6,8-TRIENOIC ACID | A | 3CBS | 0.7 | |
NCZ | 2-HYDROXY-7-METHOXY-5-METHYL-NAPHTHALENE- 1-CARBOXYLIC ACID MESO-2,5-DIHYDROXY- CYCLOPENT-3-ENYL ESTER | A | 1J5I | 0.77 | |
RMN | (R)-MANDELIC ACID | A | 1MDL | 0.79 | |
RMN | (R)-MANDELIC ACID | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 1MCZ | 0.79 | |
4TN | (2E)-3-[3-(3-ETHOXY-5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRONAPHTHALEN-2- YL)-4-HYDROXYPHENYL]ACRYLIC ACID | A | 2P1U | 0.72 | |
ADL | (1,8-DIHYDROXY-9-OXO-9,10-DIHYDRO- ANTHRACEN-2-YL)-ACETIC ACID | A,B | 1N5S | 0.72 | |
PMA | PYROMELLITIC ACID | A,B | 1FUP | 0.74 | |
DIC | 3,4-DICHLOROISOCOUMARIN | A | 1DIC | 0.72 | |
FRR | (3R,5Z,8S,9S,11E)-8,9,16-TRIHYDROXY- 14-METHOXY-3-METHYL-3,4,9,10-TETRAHYDRO- 1H-2-BENZOXACYCLOTETRADECINE-1,7(8H)- DIONE | A | 2E14 | 0.73 | |
AKV | {3-[(1R,3S)-1,3-DIHYDROXYPENTYL]- 4,5,9,10-TETRAHYDROXY-2-ANTHRYL}ACETATE | A,B,C,D | 2F99 | 0.74 | |
MPP | 3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID | A,B | 2AY3 | 0.7 | |
FL2 | FLURBIPROFEN METHYL ESTER | A,B | 1HT5 | 0.73 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MRA | 0.77 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MNS | 0.77 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1DTN | 0.77 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MDR | 0.77 | |
BPI | (1S)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE- 2,3,4-TRIOL | A,P,T | 2I9G | 0.72 | |
BPI | (1S)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE- 2,3,4-TRIOL | A | 1HWV | 0.72 | |
S1A | SORAPHEN A | A,B | 3GID | 0.77 | |
S1A | SORAPHEN A | A,B,C | 1W96 | 0.77 | |
BZR | 1S,2R,3S,4R-TETRAHYDRO-BENZO[A]ANTHRACENE- 2,3,4-TRIOL | A | 1MXJ | 0.72 | |
201 | 3-AMIDO-5-BIPHENYL-BENZOIC ACID | A | 2B0M | 0.72 | |
4MA | 4-METHYLBENZOIC ACID | A,H | 2HRG | 0.79 | |
UIN | 5,6,7,8,9,10-HEXAHYDRO-4-HYDROXY- 3-(1-PHENYLPROPYL)CYCLOOCTA[B]PYRAN- 2-ONE | B | 5UPJ | 0.77 | |
BPJ | (1R)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE- 2,3,4-TRIOL | A | 2ROU | 0.72 | |
BPJ | (1R)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE- 2,3,4-TRIOL | A | 1HX4 | 0.72 | |
L79 | (S)-(2E)-3[4-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-2-NAPHTHALENYL)TETRAHYDRO- 1-BENZOFURAN-2-YL]-2-PROPENOIC ACID | A,D | 1RDT | 0.76 | |
FLP | FLURBIPROFEN | A,B,C,D | 3PGH | 0.73 | |
FLP | FLURBIPROFEN | A,B | 1CQE | 0.73 | |
FLP | FLURBIPROFEN | A,B | 1EQH | 0.73 | |
FLP | FLURBIPROFEN | A,B | 2AYL | 0.73 | |
FLP | FLURBIPROFEN | A | 1DVT | 0.73 | |
FLP | FLURBIPROFEN | A | 1R9O | 0.73 | |
184 | 6-[HYDROXY-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTALEN-2- YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID | A | 1FCX | 0.84 | |
CIO | CILOMILAST | A,B | 1XOM | 0.7 | |
CIO | CILOMILAST | A,B | 1XLX | 0.7 | |
VII | 2,5-DIPHENYLFURAN-3,4-DICARBOXYLIC ACID | A,B | 2GFK | 0.72 | |
MPB | 4-HYDROXY-BENZOIC ACID METHYL ESTER | B,C,D | 2VK0 | 0.73 | |
MPB | 4-HYDROXY-BENZOIC ACID METHYL ESTER | A,B,D | 3MTH | 0.73 | |
OFF | 2-DEOXY-3,4-BIS-O-[3-(4-HYDROXYPHENYL)PROPANOYL]- L-THREO-PENTARIC ACID | A | 2OFF | 0.71 | |
BZA | 1R,2S,3R,4S-TETRAHYDRO-BENZO[A]ANTHRACENE- 2,3,4-TRIOL | A | 1DL4 | 0.72 | |
BZA | 1R,2S,3R,4S-TETRAHYDRO-BENZO[A]ANTHRACENE- 2,3,4-TRIOL | A | 1I7V | 0.72 | |
BZA | 1R,2S,3R,4S-TETRAHYDRO-BENZO[A]ANTHRACENE- 2,3,4-TRIOL | A | 1QBY | 0.72 | |
PIC | 6-(DIFLUORO-PHOSPHONO-METHYL)-NAPHTHALENE- 2-CARBOXYLIC ACID | A | 1BZJ | 0.75 | |
OSB | 2-SUCCINYLBENZOATE | A | 1FHV | 0.78 | |
OSB | 2-SUCCINYLBENZOATE | A,B,C,D | 1SJB | 0.78 | |
OSB | 2-SUCCINYLBENZOATE | A,B | 2QVH | 0.78 | |
TRZ | TRAZEOLIDE | A | 1C12 | 0.72 | |
973 | (5Z)-3-(4-CHLOROPHENYL)-4-HYDROXY- 5-(1-NAPHTHYLMETHYLENE)FURAN-2(5H)- ONE | A | 2Q85 | 0.73 | |
NOM | 7-HYDROXY-5-METHYL-3,3A,5,11B-TETRAHYDRO- 1,4-DIOXA-CYCLOPENTA[A]ANTHRACENE- 2,6,11-TRIONE | A | 1N5V | 0.72 | |
SWF | S-WARFARIN | A,B | 1OG5 | 0.7 | |
MCG | (S)-(ALPHA)-METHYL-4-CARBOXYPHENYLGLYCINE | A,B | 1ISS | 0.71 | |
SMN | (S)-MANDELIC ACID | A | 1MDL | 0.79 | |
NIU | 6,7,8,9-TETRAHYDRO-4-HYDROXY-3- (1-PHENYLPROPYL)CYCLOHEPTA[B]PYRAN- 2-ONE | A | 6UPJ | 0.77 | |
2NA | naphthalen-2-ylmethanol | A,B,C | 3EE5 | 0.71 | |
4CB | 4-CARBOXYPHENYLBORONIC ACID | A,B | 1KDW | 0.73 | |
TTB | 4-[(1E)-2-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRONAPHTHALEN-2- YL)PROP-1-ENYL]BENZOIC ACID | A | 1XAP | 0.83 | |
AI7 | 3-(heptyloxy)benzoic acid | A,B | 2O3Z | 0.75 | |
DFA | DIPHENYLACETIC ACID | A,B,C | 1GMY | 0.73 | |
ELI | 6-(3-METHYL-1,4-DIOXO-1,4-DIHYDRONAPHTHALEN- 2-YL)HEXANOIC ACID | A,B | 2GH5 | 0.74 | |
NPS | (2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid | A | 2VDB | 0.75 | |
OX1 | H,Y | 1LO2 | 0.73 | ||
BIK | 3,7-DIHYDROXY-2-NAPHTHOIC ACID | A | 1U5A | 0.72 | |
BIK | 3,7-DIHYDROXY-2-NAPHTHOIC ACID | A | 1U5C | 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 | 0.73 | |
HMY | (1aR,8S,13S,14S,15aR)-5,13,14-trihydroxy- 3-methoxy-8-methyl-8,9,13,14,15,15a- hexahydro-6H-oxireno[k][2]benzoxacyclotetradecine- 6,12(1aH)-dione | A,B | 3C9W | 0.71 | |
SDN | [(3S)-9-hydroxy-1-methyl-10-oxo- 4,10-dihydro-3H-benzo[g]isochromen- 3-yl]acetic acid | A,B | 3B6C | 0.73 | |
BPA | 7S,8R,9R-TRIHYDROXY-7,8,9,10-TETRAHYDRO BENZO[A]PYRENE | A | 1JDG | 0.71 | |
EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2QZZ | 0.73 | |
EMF | ethyl (1S,2S)-2-(4-hydroxy-3-methoxyphenyl)cyclopropanecarboxylate | A,B | 2R2G | 0.73 | |
NLA | NAPHTHALEN-1-YL-ACETIC ACID | A,B,C,D | 1LRH | 0.74 | |
NLA | NAPHTHALEN-1-YL-ACETIC ACID | B | 2P1O | 0.74 | |
NGV | METHYL 5,7-DIHYDROXY-2-METHYL-4,6,11- TRIOXO-3,4,6,11-TETRAHYDROTETRACENE- 1-CARBOXYLATE | A,B,C,D | 2F98 | 0.71 | |
NGV | METHYL 5,7-DIHYDROXY-2-METHYL-4,6,11- TRIOXO-3,4,6,11-TETRAHYDROTETRACENE- 1-CARBOXYLATE | A | 1SJW | 0.71 | |
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 | |
CIN | 4-CARBOXYCINNAMIC ACID | A,B,C,D | 1HAB | 0.77 | |
CIN | 4-CARBOXYCINNAMIC ACID | A,B | 1T6J | 0.77 | |
CRH | 1,2-HYDRO-1-OXY-3,4-HYDRO-3-(1- METHOXY-2-OXY-3,4-DIHYDROXYPENTYL)- 8,9-DIHYROXY-7-METHYLANTHRACENE | A,B | 146D | 0.72 | |
CRH | 1,2-HYDRO-1-OXY-3,4-HYDRO-3-(1- METHOXY-2-OXY-3,4-DIHYDROXYPENTYL)- 8,9-DIHYROXY-7-METHYLANTHRACENE | A,B | 207D | 0.72 | |
LOB | LOBELINE | A,B,C,D,E,F, G,H,I,J | 2BYS | 0.72 | |
5TN | (2E)-3-[4-HYDROXY-3-(5,5,8,8-TETRAMETHYL- 3-PROPOXY-5,6,7,8-TETRAHYDRONAPHTHALEN- 2-YL)PHENYL]ACRYLIC ACID | A | 2P1V | 0.71 | |
L41 | {4-[3-(4-acetyl-3-hydroxy-2-propylphenoxy)propoxy]phenoxy}acetic acid | A,B | 3D5F | 0.71 | |
MGI | methyl 4-(2,3-dihydroxy-5-methylphenoxy)- 2-hydroxy-6-methylbenzoate | A | 2ZA0 | 0.72 | |
ZCT | A,B,C,D,E,F, G,H | 3B6A | 0.71 | ||
156 | 4-[3-OXO-3-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL)-PROPENYL]-BENZOIC ACID | A | 1FCZ | 0.83 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1AXV | 0.71 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A,E | 2IBK | 0.71 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A,B,C,D,E,F | 2IA6 | 0.71 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1Y9H | 0.71 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1FYY | 0.71 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1AXO | 0.71 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1DXA | 0.71 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1AXL | 0.71 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A,B,D,E,F | 1S0M | 0.71 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1BPS | 0.71 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A,C | 1XC9 | 0.71 | |
AN1 | 3-(10-METHYL-ANTHRACEN-9-YL)-PROPIONIC ACID | H,Y | 1LO3 | 0.73 | |
OAL | (1,8-DIHYDROXY-9,10-DIOXO-9,10- DIHYDRO-ANTHRACEN-2-YL)-ACETIC ACID | B | 1N5T | 0.71 | |
NDH | (1R, 2S)-CIS 1,2 DIHYDROXY-1,2- DIHYDRONAPHTHALENE | A,B | 1O7P | 0.71 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K5S | 0.71 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1KEC | 0.71 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K7D | 0.71 | |
BFL | A,B | 1Q4G | 0.75 | ||
BZM | BENZOIC ACID PHENYLMETHYLESTER | A,B | 1DZM | 0.81 | |
295 | (2S,3S)-3-(4-fluorophenyl)-2,3- dihydroxypropanoic acid | A,B | 2RJR | 0.73 | |
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 | |
MAX | MATAIRESINOL | A | 2BGM | 0.75 | |
CPH | 1,8-DIHYDROXY-7-METHYL-3-(1,3,4- TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO- 2H-ANTHRACEN-9-ONE | A,B | 1D83 | 0.73 | |
CPH | 1,8-DIHYDROXY-7-METHYL-3-(1,3,4- TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO- 2H-ANTHRACEN-9-ONE | A,B | 1EKH | 0.73 | |
CPH | 1,8-DIHYDROXY-7-METHYL-3-(1,3,4- TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO- 2H-ANTHRACEN-9-ONE | A,B | 1EKI | 0.73 | |
CPH | 1,8-DIHYDROXY-7-METHYL-3-(1,3,4- TRIHYDROXY-2-OXO-PENTYL)-3,10-DIHYDRO- 2H-ANTHRACEN-9-ONE | A,B,C,D | 1VAQ | 0.73 | |
GRR | (2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid | A | 3CDS | 0.77 | |
FC3 | 5-[2-(TRIFLUOROMETHYL)PHENYL]-2- FUROIC ACID | A | 2EVC | 0.71 | |
EMT | 2-(ETHYLMERCURI-THIO)-BENZOIC ACID | A,B | 1KDG | 0.72 | |
EMT | 2-(ETHYLMERCURI-THIO)-BENZOIC ACID | A,B,C,D | 1O9L | 0.72 | |
564 | 6-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTALENE-2-CARBONYL)- NAPHTALENE-2-CARBOXYLIC ACID | A | 1FCY | 0.8 | |
CA2 | (1S,3R,4R,5S)-1,3,4-TRIHYDROXY- 5-(3-PHENOXYPROPYL)CYCLOHEXANECARBOXYLIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 2BT4 | 0.7 | |
MBO | MERCURIBENZOIC ACID | A | 2QO8 | 0.74 | |
MBO | MERCURIBENZOIC ACID | A | 1LUG | 0.74 | |
MBO | MERCURIBENZOIC ACID | A | 2HOC | 0.74 | |
MBO | MERCURIBENZOIC ACID | A | 3EFI | 0.74 | |
MBO | MERCURIBENZOIC ACID | A | 3BL0 | 0.74 | |
MBO | MERCURIBENZOIC ACID | A,B,C,D,E,F | 1NAQ | 0.74 | |
MBO | MERCURIBENZOIC ACID | A | 3CAJ | 0.74 | |
MBO | MERCURIBENZOIC ACID | A | 1DR7 | 0.74 | |
MBO | MERCURIBENZOIC ACID | A | 2HL4 | 0.74 | |
MBO | MERCURIBENZOIC ACID | A | 2GD8 | 0.74 | |
MBO | MERCURIBENZOIC ACID | A | 2QP6 | 0.74 | |
MBO | MERCURIBENZOIC ACID | A | 2HD6 | 0.74 | |
MBO | MERCURIBENZOIC ACID | A | 3C7P | 0.74 | |
MBO | MERCURIBENZOIC ACID | A,B | 2JHN | 0.74 | |
MBO | MERCURIBENZOIC ACID | A | 1DR6 | 0.74 | |
MBO | MERCURIBENZOIC ACID | A | 2HNC | 0.74 | |
MBO | MERCURIBENZOIC ACID | A | 2QOA | 0.74 | |
PHT | PHTHALIC ACID | A,B,C | 2B7P | 0.75 | |
PHT | PHTHALIC ACID | A | 3C2V | 0.75 | |
PHT | PHTHALIC ACID | A,B,C,D,E,F | 1QPR | 0.75 | |
PHT | PHTHALIC ACID | A,B | 3C2R | 0.75 | |
HZ3 | dimethyl (1R,4S)-5,6-bis(4-hydroxyphenyl)- 7-oxabicyclo[2.2.1]hepta-2,5-diene- 2,3-dicarboxylate | A,B | 2QR9 | 0.75 |