Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02295911
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 |
NLX![]() | (5A,17R)-4,5-EPOXY-3,14-DIHYDROXY- 17-METHYL-6-OXO-17-(2-PROPENYL)- MORPHINANIUM | A,B,C,D,E,F, G,H,I,J,K,L | 1MX9 | 0.89 | ![]() |
NGU![]() | U-58872, HYDROXY DERIVATIVE OF NOGALAMYCIN | A,B | 1D22 | 0.7 | ![]() |
REN![]() | (S)-reticuline | A | 3FWA | 0.77 | ![]() |
REN![]() | (S)-reticuline | A | 3D2D | 0.77 | ![]() |
AB8![]() | (1S,3R,8AS)-8-(2-{(4S,6S)-3-(4- HYDROXY-3-METHOXYBENZYL)-4-[2-(METHYLAMINO)- 2-OXOETHYL]-2-OXO-1,3-OXAZINAN- 6-YL}ETHYL)-3,7-DIMETHYL-1,2,3,7,8,8A- HEXAHYDRONAPHTHALEN-1-YL (2R)-2- METHYLBUTANOATE | A,B | 1XDG | 0.74 | ![]() |
NCS![]() | B | 1KVH | 0.71 | ![]() | |
NCS![]() | A | 2NEO | 0.71 | ![]() | |
C41![]() | ALISKIREN | C,O | 2V0Z | 0.73 | ![]() |
S2A![]() | A | 2OEY | 0.72 | ![]() | |
HEH![]() | HEDAMYCIN | A | 1JHI | 0.72 | ![]() |
MUS![]() | 4-METHYL-2-OXO-2H-CHROMEN-7-YL 5- (ACETYLAMINO)-3,5-DIDEOXY-L-ERYTHRO- NON-2-ULOPYRANOSIDONIC ACID | A | 1S0J | 0.7 | ![]() |
NOD![]() | N-ETHYLHYDROXY-DOXORUBICIN | A | 385D | 0.73 | ![]() |
DM3![]() | 6-DEOXYDAUNOMYCIN | A | 1D14 | 0.71 | ![]() |
MNG![]() | MENOGARIL | A,B | 202D | 0.73 | ![]() |
MDW![]() | (1R)-N,6-DIHYDROXY-7-METHOXY-2- [(4-METHOXYPHENYL)SULFONYL]-1,2,3,4- TETRAHYDROISOQUINOLINE-1-CARBOXAMIDE | A | 2DDY | 0.73 | ![]() |
C61![]() | (2R,4S,5S,7S)-5-AMINO-N-BUTYL-4- HYDROXY-7-[4-METHOXY-3-(3-METHOXYPROPOXY)BENZYL]- 2,8-DIMETHYLNONANAMIDE | C,O | 2V10 | 0.73 | ![]() |
NGM![]() | NOGALAMYCIN | A,B,C,D | 258D | 0.7 | ![]() |
NGM![]() | NOGALAMYCIN | A | 282D | 0.7 | ![]() |
NGM![]() | NOGALAMYCIN | A,B | 224D | 0.7 | ![]() |
NGM![]() | NOGALAMYCIN | A,B | 245D | 0.7 | ![]() |
NGM![]() | NOGALAMYCIN | A,B | 1QCH | 0.7 | ![]() |
NGM![]() | NOGALAMYCIN | A | 1D17 | 0.7 | ![]() |
NGM![]() | NOGALAMYCIN | A,B | 1D21 | 0.7 | ![]() |
NGM![]() | NOGALAMYCIN | A,B | 182D | 0.7 | ![]() |
DM9![]() | N-HYDROXYMETHYL-N-(2-METHOXYETHYL)- DAUNOMYCIN | A | 482D | 0.72 | ![]() |
NGP![]() | NOGALAMYCIN (PROTONATED FORM) | A | 1L0R | 0.73 | ![]() |
DM1![]() | DAUNOMYCIN | A | 152D | 0.7 | ![]() |
DM1![]() | DAUNOMYCIN | A,B,C,D | 1O0K | 0.7 | ![]() |
DM1![]() | DAUNOMYCIN | A | 1JO2 | 0.7 | ![]() |
DM1![]() | DAUNOMYCIN | A,B | 308D | 0.7 | ![]() |
DM1![]() | DAUNOMYCIN | A | 1D33 | 0.7 | ![]() |
DM1![]() | DAUNOMYCIN | A | 110D | 0.7 | ![]() |
DM1![]() | DAUNOMYCIN | A | 1D11 | 0.7 | ![]() |
DM1![]() | DAUNOMYCIN | A | 427D | 0.7 | ![]() |
DM1![]() | DAUNOMYCIN | A | 2D34 | 0.7 | ![]() |
DM1![]() | DAUNOMYCIN | A | 3F8F | 0.7 | ![]() |
DM1![]() | DAUNOMYCIN | A | 1D10 | 0.7 | ![]() |
DM1![]() | DAUNOMYCIN | A | 1DA0 | 0.7 | ![]() |
AP1![]() | {3-[3-(3,4-DIMETHOXY-PHENYL)-1- (1-{1-[2-(3,4,5-TRIMETHOXY-PHENYL)- BUTYRYL]-PIPERIDIN-2YL}-VINYLOXY)- PROPYL]-PHENOXY}-ACETIC ACID | A,B | 1BL4 | 0.71 | ![]() |
DM6![]() | 4'-EPIDOXORUBICIN | A | 1D15 | 0.7 | ![]() |
DM6![]() | 4'-EPIDOXORUBICIN | A | 1D54 | 0.7 | ![]() |
DM6![]() | 4'-EPIDOXORUBICIN | A | 1D58 | 0.7 | ![]() |
DM6![]() | 4'-EPIDOXORUBICIN | A | 1QDA | 0.7 | ![]() |
DM2![]() | DOXORUBICIN | A | 2DR6 | 0.7 | ![]() |
DM2![]() | DOXORUBICIN | A | 1P20 | 0.7 | ![]() |
DM2![]() | DOXORUBICIN | A | 1I1E | 0.7 | ![]() |
DM2![]() | DOXORUBICIN | A | 151D | 0.7 | ![]() |
DM2![]() | DOXORUBICIN | A | 1D12 | 0.7 | ![]() |
DM2![]() | DOXORUBICIN | A | 1DA9 | 0.7 | ![]() |
SLX![]() | (13aS)-3,10-dimethoxy-5,8,13,13a- tetrahydro-6H-isoquino[3,2-a]isoquinoline- 2,9-diol | A | 3FW9 | 0.77 | ![]() |
BDA![]() | 4-METHYLBENZYL-N-BIS[DAUNOMYCIN] | A | 1AL9 | 0.7 | ![]() |
BDA![]() | 4-METHYLBENZYL-N-BIS[DAUNOMYCIN] | A | 1AGL | 0.7 | ![]() |
MOI![]() | (7R,7AS,12BS)-3-METHYL-2,3,4,4A,7,7A- HEXAHYDRO-1H-4,12-METHANO[1]BENZOFURO[3,2- E]ISOQUINOLINE-7,9-DIOL | H,L | 1Q0Y | 0.76 | ![]() |