Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01020169
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 |
304![]() | N-[2-methyl-5-(methylcarbamoyl)phenyl]- 2-{[(1R)-1-methylpropyl]amino}- 1,3-thiazole-5-carboxamide | A | 3BX5 | 0.72 | ![]() |
2SM![]() | methyl 2-{[(4-methylpyrimidin-2- yl)carbamoyl]sulfamoyl}benzoate | A | 3EA4 | 0.76 | ![]() |
IZ1![]() | N-[(1S)-2-{4-[(5S)-1,1-dioxido- 3-oxoisothiazolidin-5-yl]phenyl}- 1-(4-phenyl-1H-imidazol-2-yl)ethyl]- 3-(trifluoromethyl)benzenesulfonamide | A | 2VEU | 0.7 | ![]() |
FOL![]() | FOLIC ACID | A | 1PJ6 | 0.71 | ![]() |
FOL![]() | FOLIC ACID | A,B | 1RD7 | 0.71 | ![]() |
FOL![]() | FOLIC ACID | A,B | 1DHF | 0.71 | ![]() |
FOL![]() | FOLIC ACID | A,B,C,D,E | 1QZF | 0.71 | ![]() |
FOL![]() | FOLIC ACID | A | 4CD2 | 0.71 | ![]() |
FOL![]() | FOLIC ACID | A | 1RX7 | 0.71 | ![]() |
FOL![]() | FOLIC ACID | A | 1RX2 | 0.71 | ![]() |
FOL![]() | FOLIC ACID | A | 1RX8 | 0.71 | ![]() |
FOL![]() | FOLIC ACID | A | 1RA2 | 0.71 | ![]() |
FOL![]() | FOLIC ACID | A,B | 1RE7 | 0.71 | ![]() |
FOL![]() | FOLIC ACID | A | 7DFR | 0.71 | ![]() |
FOL![]() | FOLIC ACID | A | 1VIF | 0.71 | ![]() |
FOL![]() | FOLIC ACID | A,B | 1RB2 | 0.71 | ![]() |
FOL![]() | FOLIC ACID | A | 1CD2 | 0.71 | ![]() |
FOL![]() | FOLIC ACID | A | 2CD2 | 0.71 | ![]() |
FOL![]() | FOLIC ACID | A,B | 1DYI | 0.71 | ![]() |
FOL![]() | FOLIC ACID | A | 1DRF | 0.71 | ![]() |
FOL![]() | FOLIC ACID | A,B,C,D | 3BMC | 0.71 | ![]() |
FOL![]() | FOLIC ACID | A,B | 2D0K | 0.71 | ![]() |
FOL![]() | FOLIC ACID | A | 1RA8 | 0.71 | ![]() |
4RB![]() | 4-(6-{[(1R)-1-(hydroxymethyl)propyl]amino}imidazo[1,2- b]pyridazin-3-yl)benzoic acid | A | 3BQR | 0.71 | ![]() |
FXG![]() | N-butyl-3-{[6-(9H-purin-6-ylamino)hexanoyl]amino}benzamide | A | 3DAJ | 0.71 | ![]() |
ED4![]() | tert-butyl 4-({(2-{(4-cyanophenyl)[(1- methyl-1H-imidazol-5-yl)methyl]amino}ethyl)[(1- methyl-1H-imidazol-4-yl)sulfonyl]amino}methyl)piperidine- 1-carboxylate | B | 3E30 | 0.71 | ![]() |
ED1![]() | B | 3E34 | 0.71 | ![]() | |
325![]() | N-{2,4-difluoro-3-[(5-pyridin-3- yl-1H-pyrrolo[2,3-b]pyridin-3-yl)carbonyl]phenyl}ethanesulfonamide | A | 3C4D | 0.7 | ![]() |
553![]() | (7S)-2-(2-aminopyrimidin-4-yl)- 7-(2-fluoroethyl)-1,5,6,7-tetrahydro- 4H-pyrrolo[3,2-c]pyridin-4-one | A,B | 3DU8 | 0.7 | ![]() |
AAI![]() | trans-4-(7-carbamoyl-1H-benzimidazol- 2-yl)-1-propylpiperidinium | A | 2RCW | 0.72 | ![]() |
IH4![]() | N-(R-CARBOXY-ETHYL)-ALPHA-(S)-(2- PHENYLETHYL) | A | 2BJU | 0.75 | ![]() |
PD8![]() | PHOSPHORYLATED DIHYDROPTEROATE | A | 1W78 | 0.73 | ![]() |
24X![]() | H,L | 2EC9 | 0.7 | ![]() | |
1SM![]() | METHYL 2-[({[(4,6-DIMETHYLPYRIMIDIN- 2-YL)AMINO]CARBONYL}AMINO)SULFONYL]BENZOATE | A,B | 1T9C | 0.72 | ![]() |
1SM![]() | METHYL 2-[({[(4,6-DIMETHYLPYRIMIDIN- 2-YL)AMINO]CARBONYL}AMINO)SULFONYL]BENZOATE | A | 1YI0 | 0.72 | ![]() |
628![]() | 4-{[6-(2,6-DICHLOROBENZOYL)IMIDAZO[1,2- A]PYRIDIN-2-YL]AMINO}BENZENESULFONAMIDE | A | 1YKR | 0.7 | ![]() |
AIQ![]() | 2,6-DIAMINO-8-(1H-IMIDAZOL-2-YLSULFANYLMETHYL)- 3H-QUINAZOLINE-4-ONE | A | 1K4G | 0.74 | ![]() |
AIQ![]() | 2,6-DIAMINO-8-(1H-IMIDAZOL-2-YLSULFANYLMETHYL)- 3H-QUINAZOLINE-4-ONE | A | 1Q63 | 0.74 | ![]() |
199![]() | N-{5-[4-(4-METHYLPIPERAZIN-1-YL)PHENYL]- 1H-PYRROLO[2,3-B]PYRIDIN-3-YL}NICOTINAMIDE | A | 1ZYS | 0.7 | ![]() |
C24![]() | 3-({2-[(4-CARBAMIMIDOYL-PHENYLAMINO)- METHYL]-3-METHYL-3H-BENZOIMIDAZOLE- 5-CARBONYL}-PYRIDIN-2-YL-AMINO)- PROPIONIC ACID ETHYL ESTER | B,C | 1KTS | 0.71 | ![]() |
S91![]() | [4-({5-(AMINOCARBONYL)-4-[(3-METHYLPHENYL)AMINO]PYRIMIDIN- 2-YL}AMINO)PHENYL]ACETIC ACID | A | 2Z8C | 0.71 | ![]() |
S91![]() | [4-({5-(AMINOCARBONYL)-4-[(3-METHYLPHENYL)AMINO]PYRIMIDIN- 2-YL}AMINO)PHENYL]ACETIC ACID | A | 2Z7L | 0.71 | ![]() |