Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03230065
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 |
184 | 6-[HYDROXY-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTALEN-2- YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID | A | 1FCX | 0.78 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A | 1OS0 | 0.7 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJI | 0.7 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJJ | 0.7 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2VS2 | 0.7 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 1OD1 | 0.7 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | E | 1EPR | 0.7 | |
EQU | EQUILENIN | A,B | 1OGX | 0.74 | |
EQU | EQUILENIN | A,B,C,D,E,F | 1QJG | 0.74 | |
EQU | EQUILENIN | A,B | 1OH0 | 0.74 | |
EQU | EQUILENIN | A | 1W6Y | 0.74 | |
EQU | EQUILENIN | A,B | 1CQS | 0.74 | |
EQU | EQUILENIN | A | 1OGZ | 0.74 | |
EQU | EQUILENIN | A | 1GS3 | 0.74 | |
EQU | EQUILENIN | A | 1OHO | 0.74 | |
TES | TESTOSTERONE | A | 1JTV | 0.72 | |
TES | TESTOSTERONE | A | 2Q7L | 0.72 | |
TES | TESTOSTERONE | A | 2Q7I | 0.72 | |
TES | TESTOSTERONE | A,B | 1J96 | 0.72 | |
TES | TESTOSTERONE | A | 2Q7K | 0.72 | |
TES | TESTOSTERONE | A,B | 1Q13 | 0.72 | |
TES | TESTOSTERONE | H | 1I9J | 0.72 | |
TES | TESTOSTERONE | A,B | 1AFS | 0.72 | |
TES | TESTOSTERONE | H | 1VPO | 0.72 | |
TES | TESTOSTERONE | A | 2Q7J | 0.72 | |
TES | TESTOSTERONE | A,B | 3BUR | 0.72 | |
TES | TESTOSTERONE | A | 2AM9 | 0.72 | |
EQI | EQUILIN | A,B | 1EQU | 0.74 | |
9TA | 1,4-BIS-[2-(2-HYDROXY-ETHYLAMINO)- ETHYLAMINO]-ANTHRAQUINONE | A,B | 1FDG | 0.7 | |
BNA | BIS-(NAPHTHYL-1-METHYL) ACETIC ACID | I | 4ER1 | 0.77 | |
BNA | BIS-(NAPHTHYL-1-METHYL) ACETIC ACID | A | 1FQ5 | 0.77 | |
TTB | 4-[(1E)-2-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRONAPHTHALEN-2- YL)PROP-1-ENYL]BENZOIC ACID | A | 1XAP | 0.74 | |
PQN | PHYLLOQUINONE | A,B,C,F,I,J, K,L,M,X | 1JB0 | 0.71 | |
PQN | PHYLLOQUINONE | 1,2,3,4,A,B, C,F,G,H,I,J, K,L | 2O01 | 0.71 | |
PQN | PHYLLOQUINONE | A,B,C,F,K,L | 2PPS | 0.71 | |
PQN | PHYLLOQUINONE | A,B,C,F,K,L | 1C51 | 0.71 | |
PQN | PHYLLOQUINONE | 0,1,2,3,4,5, 6,7,8,9,A,B, C,F,G,H,J,K, L,P,Q,R,U,V, W,Z | 1QZV | 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 | 0.72 | |
564 | 6-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTALENE-2-CARBONYL)- NAPHTALENE-2-CARBOXYLIC ACID | A | 1FCY | 0.75 | |
EST | ESTRADIOL | A,B | 1GWR | 0.73 | |
EST | ESTRADIOL | A | 1FDS | 0.73 | |
EST | ESTRADIOL | A,B,C | 1G50 | 0.73 | |
EST | ESTRADIOL | A,B,C,D,E,F | 1ERE | 0.73 | |
EST | ESTRADIOL | A,B | 1A52 | 0.73 | |
EST | ESTRADIOL | A | 1FDT | 0.73 | |
EST | ESTRADIOL | A | 2OCF | 0.73 | |
EST | ESTRADIOL | A,B,C | 1QKU | 0.73 | |
EST | ESTRADIOL | A,B,C,D,L | 1E6W | 0.73 | |
EST | ESTRADIOL | A | 1IOL | 0.73 | |
EST | ESTRADIOL | H | 1JNN | 0.73 | |
EST | ESTRADIOL | B | 1QKT | 0.73 | |
EST | ESTRADIOL | A | 1FDW | 0.73 | |
EST | ESTRADIOL | A,B | 1AQU | 0.73 | |
EST | ESTRADIOL | A | 1LHU | 0.73 | |
EST | ESTRADIOL | A | 1A27 | 0.73 | |
EST | ESTRADIOL | L | 1JGL | 0.73 | |
EST | ESTRADIOL | A,B,E,F | 1PCG | 0.73 | |
EST | ESTRADIOL | A,B,C,D | 1FDU | 0.73 | |
EST | ESTRADIOL | A | 2J7X | 0.73 | |
EST | ESTRADIOL | A,B | 2D06 | 0.73 | |
AS0 | 4-[(11BETA,17BETA)-17-METHOXY-17- (METHOXYMETHYL)-3-OXOESTRA-4,9- DIEN-11-YL]BENZALDEHYDE OXIME | A | 2OVH | 0.76 | |
AS0 | 4-[(11BETA,17BETA)-17-METHOXY-17- (METHOXYMETHYL)-3-OXOESTRA-4,9- DIEN-11-YL]BENZALDEHYDE OXIME | A | 2OVM | 0.76 | |
ELI | 6-(3-METHYL-1,4-DIOXO-1,4-DIHYDRONAPHTHALEN- 2-YL)HEXANOIC ACID | A,B | 2GH5 | 0.73 | |
MUF | (8alpha,10alpha,13alpha,17beta)- 17-[(4-hydroxyphenyl)carbonyl]androsta- 3,5-diene-3-carboxylic acid | A,B | 3BEJ | 0.73 | |
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 | 0.74 | |
BFL | A,B | 1Q4G | 0.7 | ||
E04 | 3-CARBOXAMIDO-1,3,5(10)-ESTRATRIEN- 17(R)-SPIRO-2'(5',5'-DIMETHYL-6'OXO)TETRAHYDROPYRAN | A | 1ZQ5 | 0.72 | |
ESO | O3-PHOSPHONOESTRONE | B,C | 1ESS | 0.72 | |
TRZ | TRAZEOLIDE | A | 1C12 | 0.78 | |
156 | 4-[3-OXO-3-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL)-PROPENYL]-BENZOIC ACID | A | 1FCZ | 0.76 | |
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 | 0.7 | |
FFA | (10ALPHA,13ALPHA,14BETA,17ALPHA)- 17-HYDROXYANDROST-4-EN-3-ONE | A,B | 2IPG | 0.72 | |
FFA | (10ALPHA,13ALPHA,14BETA,17ALPHA)- 17-HYDROXYANDROST-4-EN-3-ONE | A,B | 2IPJ | 0.72 | |
FFA | (10ALPHA,13ALPHA,14BETA,17ALPHA)- 17-HYDROXYANDROST-4-EN-3-ONE | A,B | 2IPF | 0.72 | |
HE7 | 4-{[(14beta,17alpha)-3-hydroxyestra- 1,3,5(10)-trien-17-yl]oxy}-4-oxobutanoic acid | A,B,C,D | 2Z77 | 0.71 | |
EED | (9BETA,11ALPHA,13ALPHA,14BETA,17ALPHA)- 11-(METHOXYMETHYL)ESTRA-1(10),2,4- TRIENE-3,17-DIOL | A,B | 2QGT | 0.71 | |
TBC | (9S,10R)-9-HYDROXY-7,8,9,10-TETRAHYDROBENZO[A]PYRENE | A | 1N8C | 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 | 0.83 | |
E3O | (16ALPHA,17ALPHA)-ESTRA-1,3,5(10)- TRIENE-3,16,17-TRIOL | A | 2J7Y | 0.72 | |
AN1 | 3-(10-METHYL-ANTHRACEN-9-YL)-PROPIONIC ACID | H,Y | 1LO3 | 0.74 | |
ESL | ESTRIOL | A | 1X8V | 0.72 |