Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00061710
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 |
2AB | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 2OUA | 0.76 |  |
| 2AB | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B,C,D | 2AJC | 0.76 | |
| 2AB | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 3PRO | 0.76 | |
| 2AB | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 2PFE | 0.76 | |
3CC | N-[(2R)-5-(aminosulfonyl)-2,3-dihydro- 1H-inden-2-yl]-2-propylpentanamide | A | 2QO8 | 0.71 | |
MAJ | indane-5-sulfonamide | A | 2QOA | 0.74 | |
DP4 | TRANS-2-(DIMETHYLPHENYLSILYL)-PIPERIDINE- N-OXIDE | A,B,C,D,E,F, G,H | 1ND0 | 0.71 | |
4FP | 4-(4-FLUOROBENZYL)PIPERIDINE | A | 2OHN | 0.71 | |
M25 | N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDE | A,B | 2NMX | 0.81 | |
| M25 | N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDE | A | 2NNS | 0.81 | |
BTM | N-benzyl-N,N-diethylethanaminium | A,B | 2Q9Y | 0.73 | |
HS4 | N-oxo-2-[(4-phenylphenyl)sulfonylamino]ethanamide | A | 3F17 | 0.71 | |
BBS | 4-TERT-BUTYLBENZENESULFONIC ACID | B | 1EOJ | 0.72 | |
| BBS | 4-TERT-BUTYLBENZENESULFONIC ACID | B | 1EOL | 0.72 | |
AES | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | A,B | 3B2Q | 0.8 | |
| AES | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | O,P,Q,R | 2B4T | 0.8 | |
| AES | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | O,P,Q,R | 2B4R | 0.8 | |
| AES | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | A,B | 3EIU | 0.8 | |
TPR | TOSYL-D-PROLINE | A | 1F4E | 0.72 | |
FTS | (3R)-3-(FLUOROMETHYL)-N-(3,3,3- TRIFLUOROPROPYL)-1,2,3,4-TETRAHYDROISOQUINOLINE- 7-SULFONAMIDE | A,B | 2G71 | 0.76 | |
4MD | N-(4-chlorobenzyl)-N-methylbenzene- 1,4-disulfonamide | A,B | 3DA2 | 0.74 | |
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 | |
SAB | 4-SULFONAMIDE-[1-(4-AMINOBUTANE)]BENZAMIDE | A | 1OKM | 0.71 | |
NDT | 2-(TOLUENE-4-SULFONYL)-2H-BENZO[D][1,2,3]DIAZABORININ- 1-OL | A,B | 1DFG | 0.72 | |
DPK | DEPRENYL | A,B | 2BYB | 0.73 | |
ZYX | 4-(2-AMINOETHYL)BENZENESULFONAMIDE | A | 2NNG | 0.82 | |
TP2 | N-[TOSYL-D-PROLINYL]AMINO-ETHANETHIOL | A,B | 1F4D | 0.71 | |
| TP2 | N-[TOSYL-D-PROLINYL]AMINO-ETHANETHIOL | A,B | 1F4C | 0.71 | |
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 | |
SKF | 1,2,3,4-TETRAHYDRO-ISOQUINOLINE- 7-SULFONIC ACID AMIDE | A,B | 1HNN | 0.8 | |
L18 | (2S)-1-methyl-2-[(2S,4R)-2-methyl- 4-phenylpentyl]piperidine | A | 2JJG | 0.75 | |
DMX | 3-[BENZYL(DIMETHYL)AMMONIO]PROPANE- 1-SULFONATE | A,B,C,D | 1TP7 | 0.8 | |
TCK | N-[(1S)-5-amino-1-(chloroacetyl)pentyl]- 4-methylbenzenesulfonamide | A | 1ARC | 0.7 | |
TSU | PARA-TOLUENE SULFONATE | A,B | 1WUW | 0.75 | |
| TSU | PARA-TOLUENE SULFONATE | A | 1B0D | 0.75 | |
F21 | (3R)-3-(FLUOROMETHYL)-7-(THIOMORPHOLIN- 4-YLSULFONYL)-1,2,3,4-TETRAHYDROISOQUINOLINE | A,B | 2G72 | 0.72 | |
| F21 | (3R)-3-(FLUOROMETHYL)-7-(THIOMORPHOLIN- 4-YLSULFONYL)-1,2,3,4-TETRAHYDROISOQUINOLINE | A,B | 2OPB | 0.72 | |
BHY | N,N'-[biphenyl-4,4'-diyldi(2R)propane- 2,1-diyl]dimethanesulfonamide | A,B | 3BBR | 0.7 | |