Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01878569
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 |
ATE | 16,17-ANDROSTENE-3-OL | A,B | 1XNX | 0.75 | |
FFA | (10ALPHA,13ALPHA,14BETA,17ALPHA)- 17-HYDROXYANDROST-4-EN-3-ONE | A,B | 2IPG | 0.71 | |
FFA | (10ALPHA,13ALPHA,14BETA,17ALPHA)- 17-HYDROXYANDROST-4-EN-3-ONE | A,B | 2IPJ | 0.71 | |
FFA | (10ALPHA,13ALPHA,14BETA,17ALPHA)- 17-HYDROXYANDROST-4-EN-3-ONE | A,B | 2IPF | 0.71 | |
CBW | (3BETA,5BETA,14BETA)-3-HYDROXY- 11-OXOOLEAN-12-EN-29-OIC ACID | A | 2W4Q | 0.71 | |
CO1 | 17-[3-(3,3-DIMETHYL-OXIRANYL)-1- METHYL-PROPYL]-10,13-DIMETHYL-2,3,4,7,8,9,10,11,12,13,14,15,16,17- TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN- 3-OL | A,B | 1P8D | 0.71 | |
VDY | 3-{2-[1-(5-HYDROXY-1,5-DIMETHYL- HEXYL)-7A-METHYL-OCTAHYDRO-INDEN- 4-YLIDENE]-ETHYLIDENE}-4-METHYLENE- CYCLOHEXANOL | A,B | 1J78 | 0.72 | |
VDY | 3-{2-[1-(5-HYDROXY-1,5-DIMETHYL- HEXYL)-7A-METHYL-OCTAHYDRO-INDEN- 4-YLIDENE]-ETHYLIDENE}-4-METHYLENE- CYCLOHEXANOL | A,D | 1MZ9 | 0.72 | |
KH1 | 5-(2-{1-[1-(4-ETHYL-4-HYDROXY-HEXYLOXY)- ETHYL]-7A-METHYL-OCTAHYDRO-INDEN- 4-YLIDENE}-ETHYLIDENE)-4-METHYLENE- CYCLOHEXANE-1,3-DIOL | A | 1IE8 | 0.7 | |
JB1 | (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)- 1-[(2R,3S)-3-(2-hydroxyethyl)heptan- 2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro- 1H-inden-4-ylidene]ethylidene]- 4-methylidene-cyclohexane-1,3-diol | A | 2ZXM | 0.7 | |
NTH | SUCCINIC ACID MONO-(13-METHYL-3- OXO-2,3,6,7,8,9,10,11,12,13,14,15,16,17- TETRADECAHYDRO-1H-CYCLOPENTA[A]PHENANTHREN- 17-YL) ESTER | A,B | 1BUQ | 0.72 | |
DGX | DIGOXIN | B,D | 1IGJ | 0.72 | |
TH2 | TESTOSTERONE HEMISUCCINATE | A,B | 2CBT | 0.72 | |
TH2 | TESTOSTERONE HEMISUCCINATE | A,B,C,D,E,F | 2CBQ | 0.72 | |
TH2 | TESTOSTERONE HEMISUCCINATE | A | 2CBO | 0.72 | |
ERG | ERGOSTEROL | A | 1BXM | 0.71 | |
ERG | ERGOSTEROL | A | 1ZHZ | 0.71 | |
ERG | ERGOSTEROL | A,B | 2AIB | 0.71 | |
HC2 | 20-HYDROXYCHOLESTEROL | A | 1ZHW | 0.7 | |
DTX | DIGITOXIGENIN | A | 1LNM | 0.86 | |
HC3 | 25-HYDROXYCHOLESTEROL | A | 1ZHX | 0.7 | |
HCR | 7-HYDROXYCHOLESTEROL | A | 1ZHT | 0.72 | |
SIH | PROGESTERONE-11-ALPHA-OL-HEMISUCCINATE | H | 1DBM | 0.7 | |
TES | TESTOSTERONE | A | 1JTV | 0.71 | |
TES | TESTOSTERONE | A | 2Q7L | 0.71 | |
TES | TESTOSTERONE | A | 2Q7I | 0.71 | |
TES | TESTOSTERONE | A,B | 1J96 | 0.71 | |
TES | TESTOSTERONE | A | 2Q7K | 0.71 | |
TES | TESTOSTERONE | A,B | 1Q13 | 0.71 | |
TES | TESTOSTERONE | H | 1I9J | 0.71 | |
TES | TESTOSTERONE | A,B | 1AFS | 0.71 | |
TES | TESTOSTERONE | H | 1VPO | 0.71 | |
TES | TESTOSTERONE | A | 2Q7J | 0.71 | |
TES | TESTOSTERONE | A,B | 3BUR | 0.71 | |
TES | TESTOSTERONE | A | 2AM9 | 0.71 | |
FUA | FUSIDIC ACID | A | 1QCA | 0.81 | |
FUA | FUSIDIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1Q23 | 0.81 | |
FUA | FUSIDIC ACID | A,B | 2VUF | 0.81 | |
PID | PERIDININ | A | 2C9E | 0.73 | |
PID | PERIDININ | M,N,O | 1PPR | 0.73 | |
JC1 | (1R,3S,5Z)-5-[(2E)-2-[(1R,3aS,7aR)- 1-[(2S,3S)-3-(2-hydroxyethyl)heptan- 2-yl]-7a-methyl-2,3,3a,5,6,7-hexahydro- 1H-inden-4-ylidene]ethylidene]- 4-methylidene-cyclohexane-1,3-diol | A | 2ZXN | 0.7 | |
DOG | DIGOXIGENIN | A | 1LKE | 0.85 | |
OBN | OUABAIN | H,L | 1IBG | 0.75 |