Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02728243
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 |
0CO | (1S,3R,5Z,7E,14beta,17alpha,23R)- 23-(2-hydroxy-2-methylpropyl)-20,24- epoxy-9,10-secochola-5,7,10-triene- 1,3-diol | A | 3CS6 | 0.71 | |
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 | 0.73 | |
AUR | AUROVERTIN B | A,B,C,D,E,F | 1COW | 0.73 | |
SWI | SWINHOLIDE A | A,B | 1YXQ | 0.72 | |
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 | 0.75 | |
DGX | DIGOXIN | B,D | 1IGJ | 0.75 | |
CBO | CARBENOXOLONE | A,B,C,D | 1HDC | 0.72 | |
CBO | CARBENOXOLONE | A,B,C,D | 2BEL | 0.72 | |
CBW | (3BETA,5BETA,14BETA)-3-HYDROXY- 11-OXOOLEAN-12-EN-29-OIC ACID | A | 2W4Q | 0.7 | |
VDY | 3-{2-[1-(5-HYDROXY-1,5-DIMETHYL- HEXYL)-7A-METHYL-OCTAHYDRO-INDEN- 4-YLIDENE]-ETHYLIDENE}-4-METHYLENE- CYCLOHEXANOL | A,B | 1J78 | 0.71 | |
VDY | 3-{2-[1-(5-HYDROXY-1,5-DIMETHYL- HEXYL)-7A-METHYL-OCTAHYDRO-INDEN- 4-YLIDENE]-ETHYLIDENE}-4-METHYLENE- CYCLOHEXANOL | A,D | 1MZ9 | 0.71 | |
COV | (1S,3R,5Z,7E,14beta,17alpha)-17- [(2S,4S)-4-(2-hydroxy-2-methylpropyl)- 2-methyltetrahydrofuran-2-yl]-9,10- secoandrosta-5,7,10-triene-1,3- diol | A | 3CS4 | 0.71 | |
PID | PERIDININ | A | 2C9E | 0.77 | |
PID | PERIDININ | M,N,O | 1PPR | 0.77 | |
FUG | FUMAGILLIN | A,B | 3FMQ | 0.74 | |
FUG | FUMAGILLIN | A | 1BOA | 0.74 | |
OBN | OUABAIN | H,L | 1IBG | 0.78 | |
AFB | 1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO- 1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN- 4-ONE | A,B,E | 1R8Q | 0.71 | |
AFB | 1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO- 1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN- 4-ONE | A | 1RE0 | 0.71 | |
AFB | 1,6,7,8,9,11A,12,13,14,14A-DECAHYDRO- 1,13-DIHYDROXY-6-METHYL-4H-CYCLOPENT[F]OXACYCLOTRIDECIN- 4-ONE | A,E | 1S9D | 0.71 | |
DOG | DIGOXIGENIN | A | 1LKE | 0.84 | |
FUA | FUSIDIC ACID | A | 1QCA | 0.82 | |
FUA | FUSIDIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1Q23 | 0.82 | |
FUA | FUSIDIC ACID | A,B | 2VUF | 0.82 | |
TH2 | TESTOSTERONE HEMISUCCINATE | A,B | 2CBT | 0.76 | |
TH2 | TESTOSTERONE HEMISUCCINATE | A,B,C,D,E,F | 2CBQ | 0.76 | |
TH2 | TESTOSTERONE HEMISUCCINATE | A | 2CBO | 0.76 | |
SIH | PROGESTERONE-11-ALPHA-OL-HEMISUCCINATE | H | 1DBM | 0.75 | |
DTX | DIGITOXIGENIN | A | 1LNM | 0.84 | |
PDN | 17,21-DIHYDROXYPREGNA-1,4-DIENE- 3,11,20-TRIONE | A | 3EAU | 0.7 | |
PDN | 17,21-DIHYDROXYPREGNA-1,4-DIENE- 3,11,20-TRIONE | A | 3EB3 | 0.7 | |
PDN | 17,21-DIHYDROXYPREGNA-1,4-DIENE- 3,11,20-TRIONE | A | 3EB4 | 0.7 | |
PDN | 17,21-DIHYDROXYPREGNA-1,4-DIENE- 3,11,20-TRIONE | A,B | 2AAX | 0.7 | |
PDN | 17,21-DIHYDROXYPREGNA-1,4-DIENE- 3,11,20-TRIONE | A | 1H61 | 0.7 | |
PDN | 17,21-DIHYDROXYPREGNA-1,4-DIENE- 3,11,20-TRIONE | A,B | 3CMF | 0.7 | |
PDN | 17,21-DIHYDROXYPREGNA-1,4-DIENE- 3,11,20-TRIONE | A | 2Q1V | 0.7 | |
ERG | ERGOSTEROL | A | 1BXM | 0.7 | |
ERG | ERGOSTEROL | A | 1ZHZ | 0.7 | |
ERG | ERGOSTEROL | A,B | 2AIB | 0.7 |