Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02414865
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 |
196 | 3-(3-FLUORO-4-HYDROXYPHENYL)-7- HYDROXY-1-NAPHTHONITRILE | A,B | 1YYE | 0.7 |  |
C3D | (5R,6S)-6-PHENYL-5-[4-(2-PYRROLIDIN- 1-YLETHOXY)PHENYL]-5,6,7,8-TETRAHYDRONAPHTHALEN- 2-OL | A | 2OUZ | 0.79 | |
DES | DIETHYLSTILBESTROL | A,B,C,D | 1S9P | 0.7 | |
| DES | DIETHYLSTILBESTROL | A,B | 3ERD | 0.7 | |
| DES | DIETHYLSTILBESTROL | A,B | 1TT6 | 0.7 | |
| DES | DIETHYLSTILBESTROL | A,B,C,D | 1TZ8 | 0.7 | |
ESL | ESTRIOL | A | 1X8V | 0.8 | |
DIN | 1,6-DIHYDROXY NAPHTHALENE | A | 1ZB6 | 0.7 | |
E3O | (16ALPHA,17ALPHA)-ESTRA-1,3,5(10)- TRIENE-3,16,17-TRIOL | A | 2J7Y | 0.8 | |
MA0 | (1R)-6-HYDROXY-N-METHYL-N-[(1Z)- PROP-2-EN-1-YLIDENE]INDAN-1-AMINIUM | A,B | 2C64 | 0.74 | |
CM4 | (2R,3R,4S)-3-(4-HYDROXYPHENYL)- 4-METHYL-2-[4-(2-PYRROLIDIN-1-YLETHOXY)PHENYL]CHROMAN- 6-OL | A | 1YIM | 0.74 | |
ETC | (R,R)-5,11-CIS-DIETHYL-5,6,11,12- TETRAHYDROCHRYSENE-2,8-DIOL | A,B | 1L2I | 0.77 | |
| ETC | (R,R)-5,11-CIS-DIETHYL-5,6,11,12- TETRAHYDROCHRYSENE-2,8-DIOL | A,B | 1L2J | 0.77 | |
REN | (S)-reticuline | A | 3FWA | 0.7 | |
| REN | (S)-reticuline | A | 3D2D | 0.7 | |
RHP | (3R)-3-(PROP-2-YNYLAMINO)INDAN- 5-OL | A,B | 1S3E | 0.72 | |
OHT | 4-HYDROXYTAMOXIFEN | A | 3ERT | 0.72 | |
| OHT | 4-HYDROXYTAMOXIFEN | A,B | 1S9Q | 0.72 | |
| OHT | 4-HYDROXYTAMOXIFEN | A,B | 1VJB | 0.72 | |
| OHT | 4-HYDROXYTAMOXIFEN | A,B,C,P,R | 2JF9 | 0.72 | |
| OHT | 4-HYDROXYTAMOXIFEN | A,B,C,D,E,F | 2GPV | 0.72 | |
| OHT | 4-HYDROXYTAMOXIFEN | A | 2GPU | 0.72 | |
| OHT | 4-HYDROXYTAMOXIFEN | A | 2P7Z | 0.72 | |
| OHT | 4-HYDROXYTAMOXIFEN | A,B | 2BJ4 | 0.72 | |
| OHT | 4-HYDROXYTAMOXIFEN | A,B | 2FSZ | 0.72 | |
HE7 | 4-{[(14beta,17alpha)-3-hydroxyestra- 1,3,5(10)-trien-17-yl]oxy}-4-oxobutanoic acid | A,B,C,D | 2Z77 | 0.74 | |
EYK | 2-tert-butylbenzene-1,4-diol | D,F | 3EYM | 0.7 | |
| EYK | 2-tert-butylbenzene-1,4-diol | B | 3EYK | 0.7 | |
17M | 17-METHYL-17-ALPHA-DIHYDROEQUILENIN | A,B | 2B1Z | 0.82 | |
BPZ | 4,4'-cyclohexane-1,1-diyldiphenol | A | 2ZKC | 0.75 | |
DRQ | (9ALPHA,13BETA,17BETA)-2-[(1Z)- BUT-1-EN-1-YL]ESTRA-1,3,5(10)-TRIENE- 3,17-DIOL | A,B | 2G5O | 0.8 | |
ESM | 1,3,5(10)-ESTRATRIEN-2,3,17-BETA- TRIOL 2-METHYL ETHER | A | 1LHW | 0.72 | |
HC6 | (2S,2'S)-2,2'-biphenyl-4,4'-diylbis(2- hydroxy-4,4-dimethylmorpholin-4- ium) | A,B | 3F2R | 0.71 | |
| HC6 | (2S,2'S)-2,2'-biphenyl-4,4'-diylbis(2- hydroxy-4,4-dimethylmorpholin-4- ium) | A,B | 3G15 | 0.71 | |
ECO | ESTRADIOL-6 CARBOXYL-METHYL-OXIME | B,D,F,H | 1JNH | 0.72 | |
1OH | 4-(1-methyl-1-phenylethyl)phenol | A | 2ZAS | 0.73 | |
CM3 | (2R,3R,4S)-5-FLUORO-3-(4-HYDROXYPHENYL)- 4-METHYL-2-[4-(2-PIPERIDIN-1-YLETHOXY)PHENYL]CHROMAN- 6-OL | A | 1YIN | 0.74 | |
ESO | O3-PHOSPHONOESTRONE | B,C | 1ESS | 0.72 | |
EZT | (17BETA)-17-{(E)-2-[2-(TRIFLUOROMETHYL)PHENYL]VINYL}ESTRA- 1(10),2,4-TRIENE-3,17-DIOL | A,B | 2P15 | 0.82 | |
TXF | (Z)-4-(1-{4-[2-(DIMETHYLAMINO)ETHOXY]PHENYL}- 5-HYDROXY-2-PHENYLPENT-1-ENYL)PHENOL | A,B,C,D,E | 2EWP | 0.72 | |
2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2E2R | 0.74 | |
| 2OH | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2P7G | 0.74 | |
BM4 | 3-[(3R)-3-ethyl-1-{9-[(3S)-3-ethyl- 3-(3-hydroxyphenyl)azepan-1-yl]nonyl}azepan- 3-yl]phenol | X | 2W6C | 0.78 | |
SDT | 3,4-dihydroxy-9,10-secoandrosta- 1(10),2,4-triene-9,17-dione | A,B | 2ZI8 | 0.71 | |
ECS | 2,3,17BETA-TRIHYDROXY-1,3,5(10)- ESTRATRIENE | A,B,C,D | 2BW7 | 0.78 | |
AOE | N-BUTYL-11-[(7R,8R,9S,13S,14S,17S)- 3,17-DIHYDROXY-13-METHYL-7,8,9,11,12,13,14,15,16,17- DECAHYDRO-6H-CYCLOPENTA[A]PHENANTHREN- 7-YL]-N-METHYLUNDECANAMIDE | A | 1HJ1 | 0.84 | |
EST | ESTRADIOL | A,B | 1GWR | 0.82 | |
| EST | ESTRADIOL | A | 1FDS | 0.82 | |
| EST | ESTRADIOL | A,B,C | 1G50 | 0.82 | |
| EST | ESTRADIOL | A,B,C,D,E,F | 1ERE | 0.82 | |
| EST | ESTRADIOL | A,B | 1A52 | 0.82 | |
| EST | ESTRADIOL | A | 1FDT | 0.82 | |
| EST | ESTRADIOL | A | 2OCF | 0.82 | |
| EST | ESTRADIOL | A,B,C | 1QKU | 0.82 | |
| EST | ESTRADIOL | A,B,C,D,L | 1E6W | 0.82 | |
| EST | ESTRADIOL | A | 1IOL | 0.82 | |
| EST | ESTRADIOL | H | 1JNN | 0.82 | |
| EST | ESTRADIOL | B | 1QKT | 0.82 | |
| EST | ESTRADIOL | A | 1FDW | 0.82 | |
| EST | ESTRADIOL | A,B | 1AQU | 0.82 | |
| EST | ESTRADIOL | A | 1LHU | 0.82 | |
| EST | ESTRADIOL | A | 1A27 | 0.82 | |
| EST | ESTRADIOL | L | 1JGL | 0.82 | |
| EST | ESTRADIOL | A,B,E,F | 1PCG | 0.82 | |
| EST | ESTRADIOL | A,B,C,D | 1FDU | 0.82 | |
| EST | ESTRADIOL | A | 2J7X | 0.82 | |
| EST | ESTRADIOL | A,B | 2D06 | 0.82 | |
EQI | EQUILIN | A,B | 1EQU | 0.76 | |
3QC | (4R)-4-(3-HYDROXYPHENYL)-N,N,7,8- TETRAMETHYL-3,4-DIHYDROISOQUINOLINE- 2(1H)-CARBOXAMIDE | A,B | 2FME | 0.75 | |
SAF | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQR | 0.72 | |
| SAF | 3-[(1S)-1-(DIMETHYLAMINO)ETHYL]PHENOL | A | 1GQS | 0.72 | |
TN1 | 5,6,7,8-TETRAHYDRONAPHTHALEN-1- OL | A | 1YSG | 0.71 | |
HXS | 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol | A,B | 3CV6 | 0.74 | |
EQU | EQUILENIN | A,B | 1OGX | 0.76 | |
| EQU | EQUILENIN | A,B,C,D,E,F | 1QJG | 0.76 | |
| EQU | EQUILENIN | A,B | 1OH0 | 0.76 | |
| EQU | EQUILENIN | A | 1W6Y | 0.76 | |
| EQU | EQUILENIN | A,B | 1CQS | 0.76 | |
| EQU | EQUILENIN | A | 1OGZ | 0.76 | |
| EQU | EQUILENIN | A | 1GS3 | 0.76 | |
| EQU | EQUILENIN | A | 1OHO | 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 | 0.72 | |
555 | 4-(4-HYDROXYPHENYL)-1-NAPHTHALDEHYDE OXIME | A,B | 2NV7 | 0.71 | |
AED | 4-(2-aminoethyl)-2-cyclohexylphenol | A | 3BUH | 0.73 | |
EED | (9BETA,11ALPHA,13ALPHA,14BETA,17ALPHA)- 11-(METHOXYMETHYL)ESTRA-1(10),2,4- TRIENE-3,17-DIOL | A,B | 2QGT | 0.79 | |