Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02224109
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 |
2IB![]() | 2-IODOBENZYL GROUP | I,J,K,L,M,N, O,P | 1GUL | 0.74 | ![]() |
NAS![]() | 2-NAPHTHALENESULFONIC ACID | I | 1QUR | 0.78 | ![]() |
NAS![]() | 2-NAPHTHALENESULFONIC ACID | E,I | 1PPC | 0.78 | ![]() |
NAS![]() | 2-NAPHTHALENESULFONIC ACID | H | 1ETS | 0.78 | ![]() |
IBZ![]() | 2-IODOBENZYLTHIO GROUP | A,B | 1CEL | 0.74 | ![]() |
NTS![]() | NAPHTHALENE TRISULFONATE | A | 1RML | 0.78 | ![]() |
I4B![]() | ISOBUTYLBENZENE | A | 184L | 0.72 | ![]() |
FPR![]() | PROPYLBENZENE | C | 1RHK | 0.74 | ![]() |
BIH![]() | NAPHTHALENE-2,6-DISULFONIC ACID | A | 1U4S | 0.76 | ![]() |
FBU![]() | 3,5-DIFLUOROBENZENESULFONAMIDE | A | 1IF6 | 0.73 | ![]() |
FBT![]() | 2,6-DIFLUOROBENZENESULFONAMIDE | A | 1IF5 | 0.73 | ![]() |
BNS![]() | HYDROSULFONYLBENZENE | 1 | 1YYY | 0.83 | ![]() |
BNS![]() | HYDROSULFONYLBENZENE | A | 1MEM | 0.83 | ![]() |
BNS![]() | HYDROSULFONYLBENZENE | A,D,E | 1FH0 | 0.83 | ![]() |
BNS![]() | HYDROSULFONYLBENZENE | A,B,C,D | 1PQ9 | 0.83 | ![]() |
BBS![]() | 4-TERT-BUTYLBENZENESULFONIC ACID | B | 1EOJ | 0.86 | ![]() |
BBS![]() | 4-TERT-BUTYLBENZENESULFONIC ACID | B | 1EOL | 0.86 | ![]() |
MAJ![]() | indane-5-sulfonamide | A | 2QOA | 0.77 | ![]() |
BPS![]() | A,B | 2DE4 | 0.84 | ![]() | |
MBN![]() | TOLUENE | A,B | 3D7O | 0.76 | ![]() |
MBN![]() | TOLUENE | A,B | 1R1X | 0.76 | ![]() |
MBN![]() | TOLUENE | A,B | 1JLX | 0.76 | ![]() |
MBN![]() | TOLUENE | A,B,C,D | 3D17 | 0.76 | ![]() |
MBN![]() | TOLUENE | A,B | 2VRL | 0.76 | ![]() |
MBN![]() | TOLUENE | A,I | 2Z3E | 0.76 | ![]() |
MBN![]() | TOLUENE | A,B | 1YZI | 0.76 | ![]() |
MBN![]() | TOLUENE | A,B | 2DN1 | 0.76 | ![]() |
MBN![]() | TOLUENE | A,B | 3EN1 | 0.76 | ![]() |
N4B![]() | N-BUTYLBENZENE | A | 186L | 0.74 | ![]() |
2AB![]() | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 2OUA | 0.75 | ![]() |
2AB![]() | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B,C,D | 2AJC | 0.75 | ![]() |
2AB![]() | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 3PRO | 0.75 | ![]() |
2AB![]() | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 2PFE | 0.75 | ![]() |
FBS![]() | 4-FLOUROBENZENESULFONAMIDE | A | 1IF4 | 0.75 | ![]() |
B69![]() | A | 2ZCR | 0.7 | ![]() | |
AES![]() | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | A,B | 3B2Q | 0.75 | ![]() |
AES![]() | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | O,P,Q,R | 2B4T | 0.75 | ![]() |
AES![]() | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | O,P,Q,R | 2B4R | 0.75 | ![]() |
AES![]() | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | A,B | 3EIU | 0.75 | ![]() |
NBB![]() | N-BUTYL-BENZENESULFONAMIDE | A,B | 3D73 | 0.7 | ![]() |
NBB![]() | N-BUTYL-BENZENESULFONAMIDE | A | 3D77 | 0.7 | ![]() |
NBB![]() | N-BUTYL-BENZENESULFONAMIDE | A,B | 3D78 | 0.7 | ![]() |
NBB![]() | N-BUTYL-BENZENESULFONAMIDE | A,B | 3CZ1 | 0.7 | ![]() |
NBB![]() | N-BUTYL-BENZENESULFONAMIDE | A | 3D75 | 0.7 | ![]() |
NBB![]() | N-BUTYL-BENZENESULFONAMIDE | A | 3D76 | 0.7 | ![]() |
NBB![]() | N-BUTYL-BENZENESULFONAMIDE | A | 3BJH | 0.7 | ![]() |
NBB![]() | N-BUTYL-BENZENESULFONAMIDE | A,B | 3D74 | 0.7 | ![]() |