Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00049841
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 |
BP7 | 1,1'-BIPHENYL-3,4-DIOL | A | 2EI0 | 0.85 | |
17M | 17-METHYL-17-ALPHA-DIHYDROEQUILENIN | A,B | 2B1Z | 0.87 | |
BPA | 7S,8R,9R-TRIHYDROXY-7,8,9,10-TETRAHYDRO BENZO[A]PYRENE | A | 1JDG | 0.72 | |
EGC | 2-(2-{2-[2-(2-{2-[2-(2-{2-[4-(1,1,3,3- TETRAMETHYL-BUTYL)-PHENOXY]-ETHOXY}- ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)- ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL | A,B | 1JP3 | 0.74 | |
EGC | 2-(2-{2-[2-(2-{2-[2-(2-{2-[4-(1,1,3,3- TETRAMETHYL-BUTYL)-PHENOXY]-ETHOXY}- ETHOXY)-ETHOXY]-ETHOXY}-ETHOXY)- ETHOXY]-ETHOXY}-ETHOXY)-ETHANOL | A | 2W22 | 0.74 | |
HE7 | 4-{[(14beta,17alpha)-3-hydroxyestra- 1,3,5(10)-trien-17-yl]oxy}-4-oxobutanoic acid | A,B,C,D | 2Z77 | 0.77 | |
226 | naphthalene-1,2,4,5,7-pentol | A,B | 2NZ5 | 0.74 | |
BPI | (1S)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE- 2,3,4-TRIOL | A,P,T | 2I9G | 0.73 | |
BPI | (1S)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE- 2,3,4-TRIOL | A | 1HWV | 0.73 | |
BZR | 1S,2R,3S,4R-TETRAHYDRO-BENZO[A]ANTHRACENE- 2,3,4-TRIOL | A | 1MXJ | 0.73 | |
DHC | CAFFEIC ACID | A,B,C,D,E,F, G,H | 2O7D | 0.72 | |
DHC | CAFFEIC ACID | A | 1KOU | 0.72 | |
ADL | (1,8-DIHYDROXY-9-OXO-9,10-DIHYDRO- ANTHRACEN-2-YL)-ACETIC ACID | A,B | 1N5S | 0.73 | |
SS1 | 1-PHENYLETHANOL | H | 1UM5 | 0.72 | |
SRL | [2-(3,5-DI-TERT-BUTYL-4-HYDROXY- PHENYL)-1-(DIETHOXY-PHOSPHORYL)- VINYL]-PHOSPHONIC ACID DIETHLYL ESTER | A | 1ILH | 0.81 | |
SRL | [2-(3,5-DI-TERT-BUTYL-4-HYDROXY- PHENYL)-1-(DIETHOXY-PHOSPHORYL)- VINYL]-PHOSPHONIC ACID DIETHLYL ESTER | A,B | 1NRL | 0.81 | |
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 | 0.79 | |
789 | 3-BROMO-6-HYDROXY-2-(4-HYDROXYPHENYL)- 1H-INDEN-1-ONE | A,B | 1ZAF | 0.71 | |
B28 | A,B | 2E9A | 0.73 | ||
NE2 | 3,3',4',5-TETRACHLOROBIPHENYL-4- OL | A,B | 2GAB | 0.72 | |
1NP | 1-NAPHTHOL | X | 2ZVQ | 0.83 | |
IPB | 5-METHYL-2-(1-METHYLETHYL)PHENOL | A,B | 1E06 | 0.85 | |
TTB | 4-[(1E)-2-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRONAPHTHALEN-2- YL)PROP-1-ENYL]BENZOIC ACID | A | 1XAP | 0.73 | |
BZA | 1R,2S,3R,4S-TETRAHYDRO-BENZO[A]ANTHRACENE- 2,3,4-TRIOL | A | 1DL4 | 0.73 | |
BZA | 1R,2S,3R,4S-TETRAHYDRO-BENZO[A]ANTHRACENE- 2,3,4-TRIOL | A | 1I7V | 0.73 | |
BZA | 1R,2S,3R,4S-TETRAHYDRO-BENZO[A]ANTHRACENE- 2,3,4-TRIOL | A | 1QBY | 0.73 | |
TN1 | 5,6,7,8-TETRAHYDRONAPHTHALEN-1- OL | A | 1YSG | 0.84 | |
BIK | 3,7-DIHYDROXY-2-NAPHTHOIC ACID | A | 1U5A | 0.71 | |
BIK | 3,7-DIHYDROXY-2-NAPHTHOIC ACID | A | 1U5C | 0.71 | |
BPJ | (1R)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE- 2,3,4-TRIOL | A | 2ROU | 0.73 | |
BPJ | (1R)-1,2,3,4-TETRAHYDRO-BENZO[C]PHENANTHRENE- 2,3,4-TRIOL | A | 1HX4 | 0.73 | |
ESL | ESTRIOL | A | 1X8V | 0.83 | |
I0G | (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)- 1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 8-OL | A,B | 2I0G | 0.73 | |
I0G | (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)- 1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 8-OL | A,B,C,D | 2I0J | 0.73 | |
564 | 6-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTALENE-2-CARBONYL)- NAPHTALENE-2-CARBOXYLIC ACID | A | 1FCY | 0.7 | |
BPM | 4-PHOSPHONOOXY-PHENYL-METHYL-[4- PHOSPHONOOXY]BENZEN | A | 1AAX | 0.77 | |
DBE | bis(4-hydroxyphenyl)methanone | A | 2VKU | 0.76 | |
EZT | (17BETA)-17-{(E)-2-[2-(TRIFLUOROMETHYL)PHENYL]VINYL}ESTRA- 1(10),2,4-TRIENE-3,17-DIOL | A,B | 2P15 | 0.84 | |
OAC | TRANS-O-HYDROXY-ALPHA-METHYL CINNAMATE | C | 3GCH | 0.75 | |
PCR | P-CRESOL | A | 1JHV | 0.81 | |
PCR | P-CRESOL | A | 1JHU | 0.81 | |
PCR | P-CRESOL | A,B,C,D | 1DIQ | 0.81 | |
BPZ | 4,4'-cyclohexane-1,1-diyldiphenol | A | 2ZKC | 0.97 | |
E3O | (16ALPHA,17ALPHA)-ESTRA-1,3,5(10)- TRIENE-3,16,17-TRIOL | A | 2J7Y | 0.83 | |
2LP | 2-ALLYLPHENOL | A | 1OV5 | 0.83 | |
ECO | ESTRADIOL-6 CARBOXYL-METHYL-OXIME | B,D,F,H | 1JNH | 0.71 | |
LJ2 | 2,6-dibromo-4-[(E)-2-phenylethenyl]phenol | A,B | 3CN1 | 0.73 | |
689 | 4-[(1S,2S,5S)-5-(HYDROXYMETHYL)- 6,8,9-TRIMETHYL-3-OXABICYCLO[3.3.1]NON- 7-EN-2-YL]PHENOL | A,B | 1ZKY | 0.8 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1S9P | 0.91 | |
DES | DIETHYLSTILBESTROL | A,B | 3ERD | 0.91 | |
DES | DIETHYLSTILBESTROL | A,B | 1TT6 | 0.91 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1TZ8 | 0.91 | |
PCQ | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 1G3M | 0.75 | |
PCQ | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 2G5U | 0.75 | |
DHR | (2S)-HYDROXY(4-HYDROXYPHENYL)ETHANENITRILE | A,B | 1E55 | 0.74 | |
H53 | 2-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE- 3,4,5-TRIOL | A | 2FF5 | 0.73 | |
H53 | 2-(2,5-DIHYDROXYPHENYL)-6-(HYDROXYMETHYL)OXANE- 3,4,5-TRIOL | A | 2FET | 0.73 | |
JJ3 | (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)- 6-(METHOXYMETHYL)-1,2,3,3A,4,9B- HEXAHYDROCYCLOPENTA[C]CHROMEN-8- OL | A,B | 2JJ3 | 0.73 | |
JJ3 | (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)- 6-(METHOXYMETHYL)-1,2,3,3A,4,9B- HEXAHYDROCYCLOPENTA[C]CHROMEN-8- OL | A,B | 2QE4 | 0.73 | |
FCR | ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL | A,B | 1E0Y | 0.76 | |
FCR | ALPHA,ALPHA,ALPHA-TRIFLUORO-P-CRESOL | A,B | 1E8G | 0.76 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.7 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG1 | 0.7 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RH0 | 0.7 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGU | 0.7 | |
OTS | 4-(2S-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.7 | |
4NA | 1-CHLORO-6-(4-HYDROXYPHENYL)-2- NAPHTHOL | A,B | 1YY4 | 0.78 | |
B76 | A,B | 2E9D | 0.72 | ||
G50 | 3-(4-HYDROXYPHENYL)-1-(2,4,6-TRIHYDROXYPHENYL)PROPAN- 1-ONE | A,B | 2UXI | 0.71 | |
EMO | 3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE | A,B | 2RH4 | 0.71 | |
EMO | 3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE | A,B | 3CSD | 0.71 | |
EMO | 3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE | A,B | 2RHR | 0.71 | |
EMO | 3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE | A | 1F0Q | 0.71 | |
EMO | 3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE | A | 3C13 | 0.71 | |
EMO | 3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE | A,B | 2RHC | 0.71 | |
EMO | 3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE | A | 3BQC | 0.71 | |
OX5 | 4-HYDROXYBENZALDEHYDE O-(3,3-DIMETHYLBUTANOYL)OXIME | A,B,C | 2OOZ | 0.72 | |
BPY | BIPHENYL-2,3-DIOL | A | 1KMY | 0.85 | |
BPY | BIPHENYL-2,3-DIOL | B | 1KW8 | 0.85 | |
BPY | BIPHENYL-2,3-DIOL | A | 2EI3 | 0.85 | |
BPY | BIPHENYL-2,3-DIOL | A | 1EIR | 0.85 | |
BPY | BIPHENYL-2,3-DIOL | B | 1KW6 | 0.85 | |
BPY | BIPHENYL-2,3-DIOL | B | 1KWC | 0.85 | |
BPY | BIPHENYL-2,3-DIOL | B | 1KW9 | 0.85 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A | 2QU9 | 0.72 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1QLU | 0.72 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1J | 0.72 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 2VAO | 0.72 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1K | 0.72 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1DZN | 0.72 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1L | 0.72 | |
EUG | 2-METHOXY-4-VINYL-PHENOL | A,B | 1W1M | 0.72 | |
3AS | (3aS,4R,9bR)-2,2-difluoro-4-(4- hydroxyphenyl)-6-(methoxymethyl)- 1,2,3,3a,4,9b-hexahydrocyclopenta[c]chromen- 8-ol | A,B | 2QTU | 0.71 | |
2MP | 3,4-DIMETHYLPHENOL | A | 1L5O | 0.84 | |
TRT | FRAGMENT OF TRITON X-100 | A,E | 2I0U | 0.74 | |
TRT | FRAGMENT OF TRITON X-100 | A,B | 1OIZ | 0.74 | |
156 | 4-[3-OXO-3-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL)-PROPENYL]-BENZOIC ACID | A | 1FCZ | 0.74 | |
2NA | naphthalen-2-ylmethanol | A,B,C | 3EE5 | 0.73 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | H,I | 1A2C | 0.73 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | A,B,C | 1CA7 | 0.73 | |
ENO | 3-(4-HYDROXY-PHENYL)PYRUVIC ACID | A,B,C,D | 3GGO | 0.73 | |
LYL | 2-ALLYL-6-METHYL-PHENOL | A | 1OV7 | 0.85 | |
T3O | 4-[(1S,2R,5S)-4,4,8-TRIMETHYL-3- OXABICYCLO[3.3.1]NON-7-EN-2-YL]PHENOL | A,B | 2G44 | 0.79 | |
ECS | 2,3,17BETA-TRIHYDROXY-1,3,5(10)- ESTRATRIENE | A,B,C,D | 2BW7 | 0.81 | |
DRQ | (9ALPHA,13BETA,17BETA)-2-[(1Z)- BUT-1-EN-1-YL]ESTRA-1,3,5(10)-TRIENE- 3,17-DIOL | A,B | 2G5O | 0.86 | |
8PP | 2-[(2E,6E,10E,14E,18E,22E,26E)- 3,7,11,15,19,23,27,31-OCTAMETHYLDOTRIACONTA- 2,6,10,14,18,22,26,30-OCTAENYL]PHENOL | A,B,C,D | 1Y0G | 0.85 | |
ANF | ANTHRONE | H | 2BJM | 0.85 | |
PFL | 2,6-BIS(1-METHYLETHYL)PHENOL | A,B | 1E7A | 0.87 | |
OAL | (1,8-DIHYDROXY-9,10-DIOXO-9,10- DIHYDRO-ANTHRACEN-2-YL)-ACETIC ACID | B | 1N5T | 0.72 | |
BP3 | 2'-CHLORO-BIPHENYL-2,3-DIOL | A | 1LGT | 0.78 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RGT | 0.7 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 1RG2 | 0.7 | |
OTR | 4-(2R-AMINO-1-HYDROXYETHYL)PHENOL | A,B | 2AN4 | 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 | 0.77 | |
DC8 | (3AS,4R,9BR)-2,2-DIFLUORO-4-(4- HYDROXYPHENYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 8-OL | A,B | 2Q70 | 0.71 | |
DC8 | (3AS,4R,9BR)-2,2-DIFLUORO-4-(4- HYDROXYPHENYL)-1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 8-OL | A,B | 2Z4B | 0.71 | |
DIN | 1,6-DIHYDROXY NAPHTHALENE | A | 1ZB6 | 0.84 | |
TBT | 8,9,10,11-TETRAHYDRO-BENZO[A]ANTHRACENE- 8,9,10-TRIOL | A | 1DJD | 0.73 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1AXV | 0.72 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A,E | 2IBK | 0.72 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A,B,C,D,E,F | 2IA6 | 0.72 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1Y9H | 0.72 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1FYY | 0.72 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1AXO | 0.72 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1DXA | 0.72 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1AXL | 0.72 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A,B,D,E,F | 1S0M | 0.72 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1BPS | 0.72 | |
BAP | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A,C | 1XC9 | 0.72 | |
AEH | 4-(2-aminoethyl)-2-ethylphenol | A | 3BUG | 0.78 | |
STL | RESVERATROL | A,B | 3CKL | 0.81 | |
STL | RESVERATROL | A,B,C,D | 1U0W | 0.81 | |
STL | RESVERATROL | A | 1CGZ | 0.81 | |
STL | RESVERATROL | A,B,C,D,E,F, G,H,I,J,K,L, M,N | 2JIZ | 0.81 | |
STL | RESVERATROL | A | 1Z1F | 0.81 | |
STL | RESVERATROL | A | 1DVS | 0.81 | |
STL | RESVERATROL | A,B | 1SG0 | 0.81 | |
TOH | (3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT- 3-ENOIC ACID | A | 2IME | 0.73 | |
TOH | (3E)-4-(2-HYDROXYPHENYL)-2-OXOBUT- 3-ENOIC ACID | A | 2IMD | 0.73 | |
555 | 4-(4-HYDROXYPHENYL)-1-NAPHTHALDEHYDE OXIME | A,B | 2NV7 | 0.78 | |
AED | 4-(2-aminoethyl)-2-cyclohexylphenol | A | 3BUH | 0.8 | |
D1N | NAPHTHALENE-1,2-DIOL | A | 2EI1 | 0.81 | |
1FL | 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID | A,B | 2BXE | 0.74 | |
1FL | 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID | A,B | 3D2T | 0.74 | |
1OH | 4-(1-methyl-1-phenylethyl)phenol | A | 2ZAS | 0.94 | |
WST | (3AS,4R,9BR)-4-(4-HYDROXYPHENYL)- 1,2,3,3A,4,9B-HEXAHYDROCYCLOPENTA[C]CHROMEN- 9-OL | A,B | 2POG | 0.72 | |
OHT | 4-HYDROXYTAMOXIFEN | A | 3ERT | 0.74 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B | 1S9Q | 0.74 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B | 1VJB | 0.74 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B,C,P,R | 2JF9 | 0.74 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B,C,D,E,F | 2GPV | 0.74 | |
OHT | 4-HYDROXYTAMOXIFEN | A | 2GPU | 0.74 | |
OHT | 4-HYDROXYTAMOXIFEN | A | 2P7Z | 0.74 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B | 2BJ4 | 0.74 | |
OHT | 4-HYDROXYTAMOXIFEN | A,B | 2FSZ | 0.74 | |
B08 | A,B | 2E99 | 0.73 | ||
SDT | 3,4-dihydroxy-9,10-secoandrosta- 1(10),2,4-triene-9,17-dione | A,B | 2ZI8 | 0.77 | |
OXN | OXTOXYNOL-10 | A | 1IKT | 0.74 | |
OXN | OXTOXYNOL-10 | A,B | 2Q32 | 0.74 | |
OXN | OXTOXYNOL-10 | A,B | 1UEH | 0.74 | |
OXN | OXTOXYNOL-10 | A,B | 2D4Q | 0.74 | |
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 | 0.77 | |
AC6 | P-HYDROXYACETOPHENONE | A | 2GQ8 | 0.72 | |
AC6 | P-HYDROXYACETOPHENONE | X | 2O48 | 0.72 | |
EPT | HEPTANYL-P-PHENOL | A,B | 1AHZ | 0.86 | |
FBR | (9aS)-4-bromo-9a-butyl-7-hydroxy- 1,2,9,9a-tetrahydro-3H-fluoren- 3-one | A | 2GIU | 0.75 | |
EST | ESTRADIOL | A,B | 1GWR | 0.85 | |
EST | ESTRADIOL | A | 1FDS | 0.85 | |
EST | ESTRADIOL | A,B,C | 1G50 | 0.85 | |
EST | ESTRADIOL | A,B,C,D,E,F | 1ERE | 0.85 | |
EST | ESTRADIOL | A,B | 1A52 | 0.85 | |
EST | ESTRADIOL | A | 1FDT | 0.85 | |
EST | ESTRADIOL | A | 2OCF | 0.85 | |
EST | ESTRADIOL | A,B,C | 1QKU | 0.85 | |
EST | ESTRADIOL | A,B,C,D,L | 1E6W | 0.85 | |
EST | ESTRADIOL | A | 1IOL | 0.85 | |
EST | ESTRADIOL | H | 1JNN | 0.85 | |
EST | ESTRADIOL | B | 1QKT | 0.85 | |
EST | ESTRADIOL | A | 1FDW | 0.85 | |
EST | ESTRADIOL | A,B | 1AQU | 0.85 | |
EST | ESTRADIOL | A | 1LHU | 0.85 | |
EST | ESTRADIOL | A | 1A27 | 0.85 | |
EST | ESTRADIOL | L | 1JGL | 0.85 | |
EST | ESTRADIOL | A,B,E,F | 1PCG | 0.85 | |
EST | ESTRADIOL | A,B,C,D | 1FDU | 0.85 | |
EST | ESTRADIOL | A | 2J7X | 0.85 | |
EST | ESTRADIOL | A,B | 2D06 | 0.85 | |
ETY | 4-ethylphenol | A,B,C,D | 2RA6 | 0.83 | |
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 | 0.89 | |
SN1 | 2,4-DIHYDROXY-TRANS CINNAMIC ACID | 1 | 1K2I | 0.73 | |
BM4 | 3-[(3R)-3-ethyl-1-{9-[(3S)-3-ethyl- 3-(3-hydroxyphenyl)azepan-1-yl]nonyl}azepan- 3-yl]phenol | X | 2W6C | 0.75 | |
ETC | (R,R)-5,11-CIS-DIETHYL-5,6,11,12- TETRAHYDROCHRYSENE-2,8-DIOL | A,B | 1L2I | 0.87 | |
ETC | (R,R)-5,11-CIS-DIETHYL-5,6,11,12- TETRAHYDROCHRYSENE-2,8-DIOL | A,B | 1L2J | 0.87 | |
HZ3 | dimethyl (1R,4S)-5,6-bis(4-hydroxyphenyl)- 7-oxabicyclo[2.2.1]hepta-2,5-diene- 2,3-dicarboxylate | A,B | 2QR9 | 0.72 | |
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 | 0.8 | |
EQU | EQUILENIN | A,B | 1OGX | 0.82 | |
EQU | EQUILENIN | A,B,C,D,E,F | 1QJG | 0.82 | |
EQU | EQUILENIN | A,B | 1OH0 | 0.82 | |
EQU | EQUILENIN | A | 1W6Y | 0.82 | |
EQU | EQUILENIN | A,B | 1CQS | 0.82 | |
EQU | EQUILENIN | A | 1OGZ | 0.82 | |
EQU | EQUILENIN | A | 1GS3 | 0.82 | |
EQU | EQUILENIN | A | 1OHO | 0.82 | |
BP6 | 2',6'-DICHLORO-BIPHENYL-2,6-DIOL | A | 1LKD | 0.76 | |
LZ2 | 5-hydroxynaphthalene-1-sulfonamide | A | 2VTH | 0.73 | |
PIT | PICEATANNOL | A,B,C,D,E,F, G,H,I,J,K,L, M,N | 2JJ1 | 0.76 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZK0 | 0.72 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJZ | 0.72 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJY | 0.72 | |
LDP | L-DOPAMINE | A,B | 2A3R | 0.71 | |
LDP | L-DOPAMINE | A | 5PAH | 0.71 | |
LDP | L-DOPAMINE | A,B | 2QMZ | 0.71 | |
LDP | L-DOPAMINE | A,B | 2VQ5 | 0.71 | |
AHT | 4-(2,5-DIAMINO-5-HYDROXY-PENTYL)- PHENOL | I,T | 1TMB | 0.72 | |
NE1 | 2',3,3',4',5-PENTACHLOROBIPHENYL- 4-OL | A,B | 2G9K | 0.72 | |
HC4 | A | 1TS6 | 0.76 | ||
HC4 | A | 3PHY | 0.76 | ||
HC4 | A | 3PYP | 0.76 | ||
HC4 | A | 1T1C | 0.76 | ||
HC4 | A | 1OT6 | 0.76 | ||
HC4 | A | 1TS0 | 0.76 | ||
HC4 | A | 1T1A | 0.76 | ||
HC4 | A | 2PYP | 0.76 | ||
HC4 | A | 2ZOI | 0.76 | ||
HC4 | A | 1OTI | 0.76 | ||
HC4 | A | 1XFQ | 0.76 | ||
HC4 | A | 2D01 | 0.76 | ||
HC4 | A,B,C,D,E,F, G,H | 2O7B | 0.76 | ||
HC4 | A | 2ZOH | 0.76 | ||
HC4 | A | 1GSW | 0.76 | ||
HC4 | A | 2QJ7 | 0.76 | ||
HC4 | A | 1F9I | 0.76 | ||
HC4 | X | 1UWP | 0.76 | ||
HC4 | A | 2PHY | 0.76 | ||
HC4 | A | 1T1B | 0.76 | ||
HC4 | A | 1F98 | 0.76 | ||
HC4 | A | 1T19 | 0.76 | ||
HC4 | X | 1UWN | 0.76 | ||
HC4 | A,B,C,D,E,F, G,H | 2O7F | 0.76 | ||
HC4 | A | 1UGU | 0.76 | ||
HC4 | A | 1TS8 | 0.76 | ||
HC4 | A,B | 1OTD | 0.76 | ||
HC4 | A | 1OTE | 0.76 | ||
HC4 | A | 1GSX | 0.76 | ||
HC4 | A | 1TS7 | 0.76 | ||
HC4 | A | 2PYR | 0.76 | ||
HC4 | A | 1S4S | 0.76 | ||
HC4 | A | 1GSV | 0.76 | ||
HC4 | A | 2I9V | 0.76 | ||
HC4 | A | 2QWS | 0.76 | ||
HC4 | A | 1XFN | 0.76 | ||
HC4 | A | 1S4R | 0.76 | ||
HC4 | A | 1T18 | 0.76 | ||
HC4 | A | 1OTA | 0.76 | ||
HC4 | A | 1D7E | 0.76 | ||
HC4 | A | 1S1Z | 0.76 | ||
HC4 | A,B,C | 1MZU | 0.76 | ||
HC4 | A,B | 1ODV | 0.76 | ||
HC4 | A,B | 2J3J | 0.76 | ||
HC4 | A | 2QJ5 | 0.76 | ||
HC4 | A | 1OTB | 0.76 | ||
HC4 | A | 2D02 | 0.76 | ||
HC4 | A | 1OT9 | 0.76 | ||
HC4 | A | 1NWZ | 0.76 | ||
HC4 | A | 1S1Y | 0.76 | ||
R12 | 9-(4-HYDROXY-2,6-DIMETHYL-PHENYL)- 3,7-DIMETHYL-NONA-4,6,8-TRIENOIC ACID | A | 3CBS | 0.82 | |
4HP | 4-HYDROXYPHENYLACETATE | A,B,C,D | 2JBT | 0.76 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYJ | 0.76 | |
4HP | 4-HYDROXYPHENYLACETATE | A | 2YYM | 0.76 | |
4HP | 4-HYDROXYPHENYLACETATE | B | 1AI6 | 0.76 | |
4HP | 4-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCG | 0.76 | |
8PS | 5-OCTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B37 | 0.77 | |
EED | (9BETA,11ALPHA,13ALPHA,14BETA,17ALPHA)- 11-(METHOXYMETHYL)ESTRA-1(10),2,4- TRIENE-3,17-DIOL | A,B | 2QGT | 0.82 | |
3HP | 3-HYDROXYPHENYLACETATE | M,N,O,P,Q,R | 3PCE | 0.72 | |
IPH | PHENOL | A,B | 2OLD | 0.71 | |
IPH | PHENOL | A,B,C,D | 2PZV | 0.71 | |
IPH | PHENOL | A | 1LI2 | 0.71 | |
IPH | PHENOL | A | 2J9N | 0.71 | |
IPH | PHENOL | A,B,C,D | 2OMB | 0.71 | |
IPH | PHENOL | A | 1JHX | 0.71 | |
IPH | PHENOL | A,B,C,D | 2VE7 | 0.71 | |
IPH | PHENOL | B,D,E,G,H,J,L | 1AI0 | 0.71 | |
IPH | PHENOL | A,B,C,D | 1FOH | 0.71 | |
IPH | PHENOL | A | 1V03 | 0.71 | |
IPH | PHENOL | A,C,E,G,I,K | 5AIY | 0.71 | |
IPH | PHENOL | B,D,F,H,J,L | 1AIY | 0.71 | |
IPH | PHENOL | A,B | 1XU5 | 0.71 | |
IPH | PHENOL | A,B,C,D,E,G, I,K | 1W8P | 0.71 | |
IPH | PHENOL | A,C,E,G,I,K | 4AIY | 0.71 | |
IPH | PHENOL | A,B,C,D,E,F, G,H | 1XDA | 0.71 | |
IPH | PHENOL | A | 2AS3 | 0.71 | |
IPH | PHENOL | A,B,C,D | 1ZEG | 0.71 | |
IPH | PHENOL | A,B,C,D | 1PN0 | 0.71 | |
IPH | PHENOL | A,B,C,D | 1XW7 | 0.71 | |
IPH | PHENOL | A,C,E,G,I,K,M | 1QIY | 0.71 | |
IPH | PHENOL | A,B,C,D | 1Q4V | 0.71 | |
IPH | PHENOL | B | 1AI7 | 0.71 | |
IPH | PHENOL | A | 1FJW | 0.71 | |
IPH | PHENOL | B,C,D | 1RWE | 0.71 | |
IPH | PHENOL | A,B,C,D,E,G, H,I,K | 1ZNJ | 0.71 | |
IPH | PHENOL | B,C,D | 3GKY | 0.71 | |
IPH | PHENOL | A | 1JHY | 0.71 | |
IPH | PHENOL | A,C,E,G,I,K | 3AIY | 0.71 | |
IPH | PHENOL | A,B | 2OMN | 0.71 | |
IPH | PHENOL | A,C,E,G,I,K | 2AIY | 0.71 | |
IPH | PHENOL | A,B,D | 1MPJ | 0.71 | |
IPH | PHENOL | A,B,C,D,F,G, H,J | 1WAV | 0.71 | |
IPH | PHENOL | B,C,D | 1LPH | 0.71 | |
CRS | M-CRESOL | A,B,C,D | 1EV3 | 0.8 | |
CRS | M-CRESOL | A,B,C,D,E,F | 2OMG | 0.8 | |
CRS | M-CRESOL | A,B | 1UZ9 | 0.8 | |
CRS | M-CRESOL | A,B,C,D | 1ZEH | 0.8 | |
CRS | M-CRESOL | A,B,C,D,E,F | 1ZEI | 0.8 | |
CRS | M-CRESOL | A,C,D,E | 7INS | 0.8 | |
CRS | M-CRESOL | A,B,C,D,E,G, I,K | 1EV6 | 0.8 | |
AEF | 4-(2-aminoethyl)phenol | A | 3BRA | 0.73 | |
FHI | A,B | 1Y1D | 0.7 | ||
MCT | 4-METHYLCATECHOL | A | 1L4G | 0.78 | |
MCT | 4-METHYLCATECHOL | A | 2EHZ | 0.78 | |
MCT | 4-METHYLCATECHOL | A,B | 1DMH | 0.78 | |
AEG | 4-[(2R)-2-aminopropyl]phenol | A | 3BUF | 0.74 | |
369 | 5-(4-hydroxyphenoxy)-6-(3-hydroxyphenyl)- 7-methylnaphthalen-2-ol | A,B | 3DT3 | 0.76 | |
5PP | 5-PENTYL-2-PHENOXYPHENOL | A,B,C,D,E,F | 2B36 | 0.77 | |
HPP | HYDROXYPHENYL PROPIONIC ACID | A,B | 2TPL | 0.76 | |
HPP | HYDROXYPHENYL PROPIONIC ACID | A,B,C,D | 3GGP | 0.76 | |
459 | 4-[(1S,2S,5S,9R)-5-(HYDROXYMETHYL)- 8,9-DIMETHYL-3-OXABICYCLO[3.3.1]NON- 7-EN-2-YL]PHENOL | A,B | 2FAI | 0.81 | |
2HC | (2E)-3-(2-HYDROXYPHENYL)ACRYLIC ACID | A,B | 1V5Z | 0.77 | |
EQI | EQUILIN | A,B | 1EQU | 0.81 | |
55E | 4-(4-hydroxy-3-methylphenyl)-6- phenylpyrimidin-2(5H)-one | A | 3DCV | 0.78 | |
ESM | 1,3,5(10)-ESTRATRIEN-2,3,17-BETA- TRIOL 2-METHYL ETHER | A | 1LHW | 0.74 | |
458 | 4-[(1S,2S,5S)-5-(HYDROXYMETHYL)- 8-METHYL-3-OXABICYCLO[3.3.1]NON- 7-EN-2-YL]PHENOL | A,B | 2B1V | 0.78 | |
OMD | 2-(3,6-DIHYDROXYPHENYL)ACETIC ACID | A,B | 1AJP | 0.71 | |
DR6 | ALPHA-[4-(1,1,3,3 - TETRAMETHYLBUTYL)PHENYL]- OMEGA-HYDROXY-POLY(OXY-1,2-ETHANEDIYL) | C,I,T | 1YTZ | 0.73 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A | 2OPA | 0.74 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A,B,C | 1MFI | 0.74 | |
FHC | 2-FLUORO-3-(4-HYDROXYPHENYL)-2E- PROPENEOATE | A,B | 1GYY | 0.74 | |
SGI | 3-(4-hydroxyphenyl)propanamide | A,B | 2R9K | 0.72 | |
178 | 4-(4-HYDROXY-3-ISOPROPYLPHENYLTHIO)- 2-ISOPROPYLPHENOL | A,B | 1TVE | 0.81 | |
TXF | (Z)-4-(1-{4-[2-(DIMETHYLAMINO)ETHOXY]PHENYL}- 5-HYDROXY-2-PHENYLPENT-1-ENYL)PHENOL | A,B,C,D,E | 2EWP | 0.75 | |
LRG | (2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid | A | 3B3K | 0.7 | |
LRG | (2S)-2-(biphenyl-4-yloxy)-3-phenylpropanoic acid | A | 3D6D | 0.7 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2E2R | 0.95 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2P7G | 0.95 | |
12M | (2-ETHYLPHENYL)METHANOL | A,B | 2F62 | 0.72 | |
43M | 4-CHLORO-3-METHYLPHENOL | A | 2P7A | 0.71 | |
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 | 0.72 | |
196 | 3-(3-FLUORO-4-HYDROXYPHENYL)-7- HYDROXY-1-NAPHTHONITRILE | A,B | 1YYE | 0.8 | |
G24 | [4-(3-BENZYL-4-HYDROXYBENZYL)-3,5- DIMETHYLPHENOXY]ACETIC ACID | A | 1Q4X | 0.76 | |
EYK | 2-tert-butylbenzene-1,4-diol | D,F | 3EYM | 0.88 | |
EYK | 2-tert-butylbenzene-1,4-diol | B | 3EYK | 0.88 | |
ESO | O3-PHOSPHONOESTRONE | B,C | 1ESS | 0.74 | |
MUF | (8alpha,10alpha,13alpha,17beta)- 17-[(4-hydroxyphenyl)carbonyl]androsta- 3,5-diene-3-carboxylic acid | A,B | 3BEJ | 0.72 | |
NPS | (2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid | A | 2VDB | 0.7 | |
OBP | A,B | 2DE3 | 0.79 | ||
TTO | (3,4-DIHYDROXY-PHENYL)-TRIPHENYL- ARSONIUM | A | 1HYZ | 0.74 | |
TF5 | 2-[(2',3',4'-TRIFLUOROBIPHENYL- 2-YL)OXY]ETHANOL | A,B | 2OP3 | 0.71 | |
TON | 2-{2-[4-(1,1,3,3-TETRAMETHYLBUTYL)PHENOXY]ETHOXY}ETHANOL | A,B | 1SEZ | 0.76 | |
BHQ | 2,5-DITERT-BUTYLBENZENE-1,4-DIOL | A,B | 2AGV | 0.86 | |
HXS | 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol | A,B | 3CV6 | 0.93 | |
LJ1 | 2,6-dimethyl-4-[(E)-2-phenylethenyl]phenol | A,B | 3CN0 | 0.91 | |
MBD | 3-METHYLCATECHOL | A | 1KNF | 0.79 | |
LJ3 | 3,5-dibromobiphenyl-4-ol | A,B | 3CN2 | 0.78 | |
OHP | (2-HYDROXYPHENYL)ACETIC ACID | A | 2INZ | 0.74 |