Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02817678
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 |
225![]() | FELODIPINE | A | 2NNJ | 0.73 | ![]() |
116![]() | 7-[4-(4-FLUORO-PHENYL)-5-HYDROXYMETHYL- 2,6-DIISOPROPYL-PYRIDIN-3-YL]-3,5- DIHYDROXY-HEPTANOIC ACID | A,B,C,D | 1HWJ | 0.77 | ![]() |
HQU![]() | 3-HYDROXYQUINALDIC ACID | C,D | 193D | 0.7 | ![]() |
MQ1![]() | 5-(4-METHOXYPHENOXY)-2,4-QUINAZOLINEDIAMINE | A,B | 1M79 | 0.7 | ![]() |
BRE![]() | 2-BIPHENYL-4-YL-6-FLUORO-3-METHYL- QUINOLINE-4-CARBOXYLIC ACID | A | 1D3G | 0.76 | ![]() |
QNC![]() | 2-CARBONYLQUINOLINE | A,B | 1MTB | 0.72 | ![]() |
QNC![]() | 2-CARBONYLQUINOLINE | A,B | 2FGV | 0.72 | ![]() |
QNC![]() | 2-CARBONYLQUINOLINE | I | 1IVQ | 0.72 | ![]() |
QNC![]() | 2-CARBONYLQUINOLINE | A,B | 2FGU | 0.72 | ![]() |
QNC![]() | 2-CARBONYLQUINOLINE | A | 1JLD | 0.72 | ![]() |
QNC![]() | 2-CARBONYLQUINOLINE | A,B | 1HXB | 0.72 | ![]() |
PRL![]() | PROFLAVIN | H,I | 1BCU | 0.72 | ![]() |
PRL![]() | PROFLAVIN | A,B,D,E | 1QVT | 0.72 | ![]() |
PRL![]() | PROFLAVIN | A,B | 2KD4 | 0.72 | ![]() |
PRL![]() | PROFLAVIN | A | 1QVU | 0.72 | ![]() |
1IQ![]() | 2-(4-ISOPROPYL-4-METHYL-5-OXO-4,5- DIHYDRO-1H-IMIDAZOL-2-YL)QUINOLINE- 3-CARBOXYLIC ACID | A | 1Z8N | 0.71 | ![]() |
550![]() | methyl (1R,2S)-2-(hydroxycarbamoyl)- 1-{4-[(2-methylquinolin-4-yl)methoxy]benzyl}cyclopropanecarboxylate | A,B | 3EDZ | 0.72 | ![]() |
IMQ![]() | (2R,3R,4S)-2-(hydroxymethyl)-1- (quinolin-8-ylmethyl)pyrrolidine- 3,4-diol | A,B | 3EPX | 0.7 | ![]() |
9AC![]() | 9-ACRIDINECARBONYL | A,B,G,J,K,L,M | 1G3X | 0.73 | ![]() |
HQO![]() | 2-HEPTYL-4-HYDROXY QUINOLINE N- OXIDE | A,B,C | 1KQG | 0.78 | ![]() |
HQO![]() | 2-HEPTYL-4-HYDROXY QUINOLINE N- OXIDE | A,B,C,D,E,F | 2VR0 | 0.78 | ![]() |
HQO![]() | 2-HEPTYL-4-HYDROXY QUINOLINE N- OXIDE | A,B,C,M,N,O,P | 1KF6 | 0.78 | ![]() |
35A![]() | N-[(5R,14R)-5-AMINO-5,14-DIMETHYL- 4-OXO-3-OXA-18-AZATRICYCLO[15.3.1.1~7,11~]DOCOSA- 1(21),7(22),8,10,17,19-HEXAEN-19- YL]-N-METHYLMETHANESULFONAMIDE | A | 2PH8 | 0.71 | ![]() |
QNO![]() | 2-NONYL-4-HYDROXYQUINOLINE N-OXIDE | C,D,E | 1NU1 | 0.78 | ![]() |
QNO![]() | 2-NONYL-4-HYDROXYQUINOLINE N-OXIDE | A,B,C,D,G | 2E75 | 0.78 | ![]() |
238![]() | A | 2PRH | 0.72 | ![]() | |
FBQ![]() | 1-[3-({[(4-AMINO-5-FLUORO-2-METHYLQUINOLIN- 3-YL)METHYL]THIO}METHYL)PHENYL]- 2,2,2-TRIFLUOROETHANE-1,1-DIOL | A | 1HBJ | 0.73 | ![]() |
BRF![]() | A | 1UUO | 0.76 | ![]() | |
THA![]() | TACRINE | A,B | 2AOW | 0.73 | ![]() |
THA![]() | TACRINE | A,B,C,D,E,F | 1MX1 | 0.73 | ![]() |
THA![]() | TACRINE | A,B | 2AOX | 0.73 | ![]() |
THA![]() | TACRINE | A | 1ACJ | 0.73 | ![]() |
PF7![]() | 4-(quinolin-3-ylmethyl)piperidine- 1-carboxylic acid | A,B | 2VYA | 0.7 | ![]() |
DPY![]() | A,B | 1JES | 0.7 | ![]() | |
QND![]() | QUINALDIC ACID | A,B | 1IDA | 0.78 | ![]() |
772![]() | 2-CYANOQUINOLIN-8-YL DIHYDROGEN PHOSPHATE | A | 1O4H | 0.71 | ![]() |
T98![]() | 5-(4,4-DIMETHYL-2-THIOXO-1,4-DIHYDRO- 2H-3,1-BENZOXAZIN-6-YL)-1-METHYL- 1H-PYRROLE-2-CARBONITRILE | A,B | 1ZUC | 0.75 | ![]() |