Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02480054
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 |
17M![]() | 17-METHYL-17-ALPHA-DIHYDROEQUILENIN | A,B | 2B1Z | 0.81 | ![]() |
555![]() | 4-(4-HYDROXYPHENYL)-1-NAPHTHALDEHYDE OXIME | A,B | 2NV7 | 0.74 | ![]() |
2MP![]() | 3,4-DIMETHYLPHENOL | A | 1L5O | 0.72 | ![]() |
TN1![]() | 5,6,7,8-TETRAHYDRONAPHTHALEN-1- OL | A | 1YSG | 0.74 | ![]() |
AED![]() | 4-(2-aminoethyl)-2-cyclohexylphenol | A | 3BUH | 0.71 | ![]() |
MA0![]() | (1R)-6-HYDROXY-N-METHYL-N-[(1Z)- PROP-2-EN-1-YLIDENE]INDAN-1-AMINIUM | A,B | 2C64 | 0.75 | ![]() |
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 | 0.76 | ![]() |
ANF![]() | ANTHRONE | H | 2BJM | 0.72 | ![]() |
BM4![]() | 3-[(3R)-3-ethyl-1-{9-[(3S)-3-ethyl- 3-(3-hydroxyphenyl)azepan-1-yl]nonyl}azepan- 3-yl]phenol | X | 2W6C | 0.71 | ![]() |
EQU![]() | EQUILENIN | A,B | 1OGX | 0.77 | ![]() |
EQU![]() | EQUILENIN | A,B,C,D,E,F | 1QJG | 0.77 | ![]() |
EQU![]() | EQUILENIN | A,B | 1OH0 | 0.77 | ![]() |
EQU![]() | EQUILENIN | A | 1W6Y | 0.77 | ![]() |
EQU![]() | EQUILENIN | A,B | 1CQS | 0.77 | ![]() |
EQU![]() | EQUILENIN | A | 1OGZ | 0.77 | ![]() |
EQU![]() | EQUILENIN | A | 1GS3 | 0.77 | ![]() |
EQU![]() | EQUILENIN | A | 1OHO | 0.77 | ![]() |
E3O![]() | (16ALPHA,17ALPHA)-ESTRA-1,3,5(10)- TRIENE-3,16,17-TRIOL | A | 2J7Y | 0.81 | ![]() |
ESL![]() | ESTRIOL | A | 1X8V | 0.81 | ![]() |
EQI![]() | EQUILIN | A,B | 1EQU | 0.77 | ![]() |
ECO![]() | ESTRADIOL-6 CARBOXYL-METHYL-OXIME | B,D,F,H | 1JNH | 0.8 | ![]() |
ECS![]() | 2,3,17BETA-TRIHYDROXY-1,3,5(10)- ESTRATRIENE | A,B,C,D | 2BW7 | 0.79 | ![]() |
HE7![]() | 4-{[(14beta,17alpha)-3-hydroxyestra- 1,3,5(10)-trien-17-yl]oxy}-4-oxobutanoic acid | A,B,C,D | 2Z77 | 0.75 | ![]() |
SDT![]() | 3,4-dihydroxy-9,10-secoandrosta- 1(10),2,4-triene-9,17-dione | A,B | 2ZI8 | 0.72 | ![]() |
2OH![]() | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2E2R | 0.75 | ![]() |
2OH![]() | 4,4'-PROPANE-2,2-DIYLDIPHENOL | A | 2P7G | 0.75 | ![]() |
EED![]() | (9BETA,11ALPHA,13ALPHA,14BETA,17ALPHA)- 11-(METHOXYMETHYL)ESTRA-1(10),2,4- TRIENE-3,17-DIOL | A,B | 2QGT | 0.8 | ![]() |
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 | 0.73 | ![]() |
EZT![]() | (17BETA)-17-{(E)-2-[2-(TRIFLUOROMETHYL)PHENYL]VINYL}ESTRA- 1(10),2,4-TRIENE-3,17-DIOL | A,B | 2P15 | 0.8 | ![]() |
1OH![]() | 4-(1-methyl-1-phenylethyl)phenol | A | 2ZAS | 0.75 | ![]() |
196![]() | 3-(3-FLUORO-4-HYDROXYPHENYL)-7- HYDROXY-1-NAPHTHONITRILE | A,B | 1YYE | 0.71 | ![]() |
55E![]() | 4-(4-hydroxy-3-methylphenyl)-6- phenylpyrimidin-2(5H)-one | A | 3DCV | 0.75 | ![]() |
DES![]() | DIETHYLSTILBESTROL | A,B,C,D | 1S9P | 0.71 | ![]() |
DES![]() | DIETHYLSTILBESTROL | A,B | 3ERD | 0.71 | ![]() |
DES![]() | DIETHYLSTILBESTROL | A,B | 1TT6 | 0.71 | ![]() |
DES![]() | DIETHYLSTILBESTROL | A,B,C,D | 1TZ8 | 0.71 | ![]() |
ETC![]() | (R,R)-5,11-CIS-DIETHYL-5,6,11,12- TETRAHYDROCHRYSENE-2,8-DIOL | A,B | 1L2I | 0.76 | ![]() |
ETC![]() | (R,R)-5,11-CIS-DIETHYL-5,6,11,12- TETRAHYDROCHRYSENE-2,8-DIOL | A,B | 1L2J | 0.76 | ![]() |
DIN![]() | 1,6-DIHYDROXY NAPHTHALENE | A | 1ZB6 | 0.71 | ![]() |
BPZ![]() | 4,4'-cyclohexane-1,1-diyldiphenol | A | 2ZKC | 0.76 | ![]() |
RM2![]() | 4-HYDROXY-N-PROPARGYL-1(R)-AMINOINDAN | A,B | 2C66 | 0.72 | ![]() |
EST![]() | ESTRADIOL | A,B | 1GWR | 0.83 | ![]() |
EST![]() | ESTRADIOL | A | 1FDS | 0.83 | ![]() |
EST![]() | ESTRADIOL | A,B,C | 1G50 | 0.83 | ![]() |
EST![]() | ESTRADIOL | A,B,C,D,E,F | 1ERE | 0.83 | ![]() |
EST![]() | ESTRADIOL | A,B | 1A52 | 0.83 | ![]() |
EST![]() | ESTRADIOL | A | 1FDT | 0.83 | ![]() |
EST![]() | ESTRADIOL | A | 2OCF | 0.83 | ![]() |
EST![]() | ESTRADIOL | A,B,C | 1QKU | 0.83 | ![]() |
EST![]() | ESTRADIOL | A,B,C,D,L | 1E6W | 0.83 | ![]() |
EST![]() | ESTRADIOL | A | 1IOL | 0.83 | ![]() |
EST![]() | ESTRADIOL | H | 1JNN | 0.83 | ![]() |
EST![]() | ESTRADIOL | B | 1QKT | 0.83 | ![]() |
EST![]() | ESTRADIOL | A | 1FDW | 0.83 | ![]() |
EST![]() | ESTRADIOL | A,B | 1AQU | 0.83 | ![]() |
EST![]() | ESTRADIOL | A | 1LHU | 0.83 | ![]() |
EST![]() | ESTRADIOL | A | 1A27 | 0.83 | ![]() |
EST![]() | ESTRADIOL | L | 1JGL | 0.83 | ![]() |
EST![]() | ESTRADIOL | A,B,E,F | 1PCG | 0.83 | ![]() |
EST![]() | ESTRADIOL | A,B,C,D | 1FDU | 0.83 | ![]() |
EST![]() | ESTRADIOL | A | 2J7X | 0.83 | ![]() |
EST![]() | ESTRADIOL | A,B | 2D06 | 0.83 | ![]() |
ESO![]() | O3-PHOSPHONOESTRONE | B,C | 1ESS | 0.73 | ![]() |
IPB![]() | 5-METHYL-2-(1-METHYLETHYL)PHENOL | A,B | 1E06 | 0.71 | ![]() |
1NP![]() | 1-NAPHTHOL | X | 2ZVQ | 0.72 | ![]() |
EYK![]() | 2-tert-butylbenzene-1,4-diol | D,F | 3EYM | 0.71 | ![]() |
EYK![]() | 2-tert-butylbenzene-1,4-diol | B | 3EYK | 0.71 | ![]() |
DRQ![]() | (9ALPHA,13BETA,17BETA)-2-[(1Z)- BUT-1-EN-1-YL]ESTRA-1,3,5(10)-TRIENE- 3,17-DIOL | A,B | 2G5O | 0.81 | ![]() |
LJ1![]() | 2,6-dimethyl-4-[(E)-2-phenylethenyl]phenol | A,B | 3CN0 | 0.7 | ![]() |
HXS![]() | 4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol | A,B | 3CV6 | 0.75 | ![]() |
ESM![]() | 1,3,5(10)-ESTRATRIEN-2,3,17-BETA- TRIOL 2-METHYL ETHER | A | 1LHW | 0.73 | ![]() |
EPT![]() | HEPTANYL-P-PHENOL | A,B | 1AHZ | 0.71 | ![]() |