Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01079030
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 |
NP2![]() | N-(3-AMINOPROPYL)-2-NITROBENZENAMINE | A | 1WUM | 0.75 | ![]() |
IAP![]() | 4-IODO-ACETAMIDO PHENYLBORONIC ACID | A | 1S6R | 0.77 | ![]() |
IAP![]() | 4-IODO-ACETAMIDO PHENYLBORONIC ACID | A,B | 1K6S | 0.77 | ![]() |
LJG![]() | N,N'-(iminodiethane-2,1-diyl)bis[4- amino-N-(2-methylpropyl)benzenesulfonamide] | B | 3BGB | 0.71 | ![]() |
APB![]() | M-AMINOPHENYLBORONIC ACID | A,B | 3BLS | 0.78 | ![]() |
264![]() | (phenylamino)acetonitrile | A | 2RBN | 0.83 | ![]() |
OSP![]() | SULTHIAME | A | 2Q1Q | 0.77 | ![]() |
171![]() | 2-PHENYLAMINO-ETHANESULFONIC ACID | A,B | 1SXG | 0.9 | ![]() |
CIU![]() | N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA | A,B | 1EK1 | 0.73 | ![]() |
CIU![]() | N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA | A | 1VJ5 | 0.73 | ![]() |
1AN![]() | 2-FLUOROANILINE | A | 1LGW | 0.73 | ![]() |
NYL![]() | N-ALLYL-ANILINE | A | 1OVK | 0.85 | ![]() |
NBE![]() | NITROSOBENZENE | A | 1LH7 | 0.7 | ![]() |
NBE![]() | NITROSOBENZENE | A | 2LH7 | 0.7 | ![]() |
NBE![]() | NITROSOBENZENE | A | 2NSS | 0.7 | ![]() |
IDM![]() | INDOLINE | A,B | 3CEP | 0.73 | ![]() |
IDM![]() | INDOLINE | A | 1AEK | 0.73 | ![]() |
BSU![]() | 1,3-DIPHENYLUREA | A | 3E85 | 0.75 | ![]() |
BSU![]() | 1,3-DIPHENYLUREA | A | 2ZJF | 0.75 | ![]() |
ANL![]() | ANILINE | A | 2OV4 | 0.76 | ![]() |
ANL![]() | ANILINE | A | 1AEE | 0.76 | ![]() |
ANL![]() | ANILINE | A | 1PPA | 0.76 | ![]() |
ANL![]() | ANILINE | A | 1HJ9 | 0.76 | ![]() |
DBP![]() | 1,3-DIAMINOBENZYL PHENYLALANINE | A | 1A85 | 0.71 | ![]() |
5AN![]() | 3,5-DIFLUOROANILINE | A | 1LGX | 0.71 | ![]() |
ASR![]() | 4-AMINOPHENYLARSONIC ACID | A | 1N4F | 0.78 | ![]() |
1MR![]() | N-METHYLANILINE | X | 2OTZ | 0.87 | ![]() |
34T![]() | (3R)-8-(dioxidosulfanyl)-3-methyl- 1,2,3,4-tetrahydroquinoline | H | 1ETR | 0.7 | ![]() |
AMS![]() | 3-MERCURI-4-AMINOBENZENESULFONAMIDE | A | 3CA2 | 0.76 | ![]() |