Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03729024
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 |
AES![]() | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | A,B | 3B2Q | 0.79 | ![]() |
AES![]() | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | O,P,Q,R | 2B4T | 0.79 | ![]() |
AES![]() | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | O,P,Q,R | 2B4R | 0.79 | ![]() |
AES![]() | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | A,B | 3EIU | 0.79 | ![]() |
M25![]() | N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDE | A,B | 2NMX | 0.76 | ![]() |
M25![]() | N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDE | A | 2NNS | 0.76 | ![]() |
MAJ![]() | indane-5-sulfonamide | A | 2QOA | 0.74 | ![]() |
FBU![]() | 3,5-DIFLUOROBENZENESULFONAMIDE | A | 1IF6 | 0.73 | ![]() |
FBT![]() | 2,6-DIFLUOROBENZENESULFONAMIDE | A | 1IF5 | 0.73 | ![]() |
SKF![]() | 1,2,3,4-TETRAHYDRO-ISOQUINOLINE- 7-SULFONIC ACID AMIDE | A,B | 1HNN | 0.7 | ![]() |
DMX![]() | 3-[BENZYL(DIMETHYL)AMMONIO]PROPANE- 1-SULFONATE | A,B,C,D | 1TP7 | 0.75 | ![]() |
BBS![]() | 4-TERT-BUTYLBENZENESULFONIC ACID | B | 1EOJ | 0.72 | ![]() |
BBS![]() | 4-TERT-BUTYLBENZENESULFONIC ACID | B | 1EOL | 0.72 | ![]() |
BPS![]() | A,B | 2DE4 | 0.71 | ![]() | |
NBB![]() | N-BUTYL-BENZENESULFONAMIDE | A,B | 3D73 | 0.76 | ![]() |
NBB![]() | N-BUTYL-BENZENESULFONAMIDE | A | 3D77 | 0.76 | ![]() |
NBB![]() | N-BUTYL-BENZENESULFONAMIDE | A,B | 3D78 | 0.76 | ![]() |
NBB![]() | N-BUTYL-BENZENESULFONAMIDE | A,B | 3CZ1 | 0.76 | ![]() |
NBB![]() | N-BUTYL-BENZENESULFONAMIDE | A | 3D75 | 0.76 | ![]() |
NBB![]() | N-BUTYL-BENZENESULFONAMIDE | A | 3D76 | 0.76 | ![]() |
NBB![]() | N-BUTYL-BENZENESULFONAMIDE | A | 3BJH | 0.76 | ![]() |
NBB![]() | N-BUTYL-BENZENESULFONAMIDE | A,B | 3D74 | 0.76 | ![]() |
TOS![]() | P-SULFINOTOLUENE | H | 1ETT | 0.74 | ![]() |
TOS![]() | P-SULFINOTOLUENE | I | 4PAD | 0.74 | ![]() |
TOS![]() | P-SULFINOTOLUENE | A | 1EST | 0.74 | ![]() |
TOS![]() | P-SULFINOTOLUENE | C,G | 2CHA | 0.74 | ![]() |
TOS![]() | P-SULFINOTOLUENE | E | 1PPH | 0.74 | ![]() |
NDT![]() | 2-(TOLUENE-4-SULFONYL)-2H-BENZO[D][1,2,3]DIAZABORININ- 1-OL | A,B | 1DFG | 0.71 | ![]() |
ZYX![]() | 4-(2-AMINOETHYL)BENZENESULFONAMIDE | A | 2NNG | 0.79 | ![]() |
FTS![]() | (3R)-3-(FLUOROMETHYL)-N-(3,3,3- TRIFLUOROPROPYL)-1,2,3,4-TETRAHYDROISOQUINOLINE- 7-SULFONAMIDE | A,B | 2G71 | 0.72 | ![]() |
2AB![]() | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 2OUA | 0.73 | ![]() |
2AB![]() | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B,C,D | 2AJC | 0.73 | ![]() |
2AB![]() | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 3PRO | 0.73 | ![]() |
2AB![]() | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 2PFE | 0.73 | ![]() |
FBS![]() | 4-FLOUROBENZENESULFONAMIDE | A | 1IF4 | 0.73 | ![]() |
TSU![]() | PARA-TOLUENE SULFONATE | A,B | 1WUW | 0.75 | ![]() |
TSU![]() | PARA-TOLUENE SULFONATE | A | 1B0D | 0.75 | ![]() |