Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02364632
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 |
267 | 1-(azidomethyl)-3-methylbenzene | A | 2RBQ | 0.71 | |
PRA | 3-PHENYLPROPYLAMINE | A | 1TNK | 0.71 | |
PRA | 3-PHENYLPROPYLAMINE | M | 1UTL | 0.71 | |
PBN | 4-PHENYLBUTYLAMINE | A | 1TNI | 0.71 | |
PBN | 4-PHENYLBUTYLAMINE | A | 1UTP | 0.71 | |
3CC | N-[(2R)-5-(aminosulfonyl)-2,3-dihydro- 1H-inden-2-yl]-2-propylpentanamide | A | 2QO8 | 0.71 | |
STB | 4-SULFONAMIDE-[4-(THIOMETHYLAMINOBUTANE)]BENZAMIDE | A | 1OKN | 0.75 | |
SAN | SULFANILAMIDE | A | 1AJ0 | 0.72 | |
TSU | PARA-TOLUENE SULFONATE | A,B | 1WUW | 0.71 | |
TSU | PARA-TOLUENE SULFONATE | A | 1B0D | 0.71 | |
NBB | N-BUTYL-BENZENESULFONAMIDE | A,B | 3D73 | 0.8 | |
NBB | N-BUTYL-BENZENESULFONAMIDE | A | 3D77 | 0.8 | |
NBB | N-BUTYL-BENZENESULFONAMIDE | A,B | 3D78 | 0.8 | |
NBB | N-BUTYL-BENZENESULFONAMIDE | A,B | 3CZ1 | 0.8 | |
NBB | N-BUTYL-BENZENESULFONAMIDE | A | 3D75 | 0.8 | |
NBB | N-BUTYL-BENZENESULFONAMIDE | A | 3D76 | 0.8 | |
NBB | N-BUTYL-BENZENESULFONAMIDE | A | 3BJH | 0.8 | |
NBB | N-BUTYL-BENZENESULFONAMIDE | A,B | 3D74 | 0.8 | |
I7C | 4-AMINO-6-(TRIFLUOROMETHYL)BENZENE- 1,3-DISULFONAMIDE | A | 2POW | 0.72 | |
AL5 | THIOPHENE-2,5-DISULFONIC ACID 2- AMIDE-5-(4-METHYL-BENZYLAMIDE) | A | 1BN1 | 0.82 | |
BZZ | BENZYLHYDRAZINE | A,B | 2E2V | 0.7 | |
PO0 | 1-BENZYL-(R)-PROPYLAMINE | A,I | 1LZQ | 0.71 | |
PO0 | 1-BENZYL-(R)-PROPYLAMINE | B,I | 1M0B | 0.71 | |
PEA | 2-PHENYLETHYLAMINE | A,B,E,F,G,H | 1MHW | 0.72 | |
PEA | 2-PHENYLETHYLAMINE | A | 1TNJ | 0.72 | |
PEA | 2-PHENYLETHYLAMINE | D,H | 2HKM | 0.72 | |
PEA | 2-PHENYLETHYLAMINE | A | 1UTO | 0.72 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6Y | 0.72 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6Z | 0.72 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6U | 0.72 | |
PEA | 2-PHENYLETHYLAMINE | A | 1UTM | 0.72 | |
LJH | N,N'-(iminodiethane-2,1-diyl)bis(4- amino-N-benzylbenzenesulfonamide) | A,B | 3BGC | 0.7 | |
2AB | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 2OUA | 0.82 | |
2AB | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B,C,D | 2AJC | 0.82 | |
2AB | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 3PRO | 0.82 | |
2AB | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 2PFE | 0.82 | |
FTS | (3R)-3-(FLUOROMETHYL)-N-(3,3,3- TRIFLUOROPROPYL)-1,2,3,4-TETRAHYDROISOQUINOLINE- 7-SULFONAMIDE | A,B | 2G71 | 0.76 | |
AM4 | 4-(METHYLSULFONYL)BENZENECARBOXIMIDAMIDE | A | 1TX8 | 0.76 | |
MAJ | indane-5-sulfonamide | A | 2QOA | 0.72 | |
M25 | N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDE | A,B | 2NMX | 0.8 | |
M25 | N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDE | A | 2NNS | 0.8 | |
TRJ | META-DI(AMINOMETHYL)BENZENE | A,I | 1GVV | 0.74 | |
TRJ | META-DI(AMINOMETHYL)BENZENE | A | 1FQ5 | 0.74 | |
BSB | N-BENZYL-4-SULFAMOYL-BENZAMIDE | A | 1G4O | 0.71 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBM | 0.73 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBD | 0.73 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1P06 | 0.73 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBI | 0.73 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 8LPR | 0.73 | |
TCK | N-[(1S)-5-amino-1-(chloroacetyl)pentyl]- 4-methylbenzenesulfonamide | A | 1ARC | 0.75 | |
FBA | 4-FLUOROBENZYLAMINE | B,D,E | 1AFQ | 0.71 | |
FBA | 4-FLUOROBENZYLAMINE | A | 1TNH | 0.71 | |
4MD | N-(4-chlorobenzyl)-N-methylbenzene- 1,4-disulfonamide | A,B | 3DA2 | 0.76 | |
F21 | (3R)-3-(FLUOROMETHYL)-7-(THIOMORPHOLIN- 4-YLSULFONYL)-1,2,3,4-TETRAHYDROISOQUINOLINE | A,B | 2G72 | 0.73 | |
F21 | (3R)-3-(FLUOROMETHYL)-7-(THIOMORPHOLIN- 4-YLSULFONYL)-1,2,3,4-TETRAHYDROISOQUINOLINE | A,B | 2OPB | 0.73 | |
NR2 | N-({[4-(AMINOSULFONYL)PHENYL]AMINO}CARBONYL)- 4-METHYLBENZENESULFONAMIDE | A | 1ZFK | 0.7 | |
TP2 | N-[TOSYL-D-PROLINYL]AMINO-ETHANETHIOL | A,B | 1F4D | 0.71 | |
TP2 | N-[TOSYL-D-PROLINYL]AMINO-ETHANETHIOL | A,B | 1F4C | 0.71 | |
DMX | 3-[BENZYL(DIMETHYL)AMMONIO]PROPANE- 1-SULFONATE | A,B,C,D | 1TP7 | 0.76 | |
SKF | 1,2,3,4-TETRAHYDRO-ISOQUINOLINE- 7-SULFONIC ACID AMIDE | A,B | 1HNN | 0.8 | |
ABN | BENZYLAMINE | D,H | 2HXC | 0.74 | |
ABN | BENZYLAMINE | A,I | 1A86 | 0.74 | |
ABN | BENZYLAMINE | A | 1UTN | 0.74 | |
ABN | BENZYLAMINE | A | 1N6X | 0.74 | |
ABN | BENZYLAMINE | A | 2BZA | 0.74 | |
ABN | BENZYLAMINE | A | 2EUS | 0.74 | |
ABN | BENZYLAMINE | A | 1N6Y | 0.74 | |
ABN | BENZYLAMINE | A | 1UTJ | 0.74 | |
NFP | 3-AMINO-5-PHENYLPENTANE | A | 1MEM | 0.71 | |
NFP | 3-AMINO-5-PHENYLPENTANE | A,D,E | 1FH0 | 0.71 | |
AES | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | A,B | 3B2Q | 0.86 | |
AES | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | O,P,Q,R | 2B4T | 0.86 | |
AES | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | O,P,Q,R | 2B4R | 0.86 | |
AES | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | A,B | 3EIU | 0.86 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,C | 2AOI | 0.71 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOF | 0.71 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOJ | 0.71 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOH | 0.71 | |
SAB | 4-SULFONAMIDE-[1-(4-AMINOBUTANE)]BENZAMIDE | A | 1OKM | 0.75 | |
G0G | N,N'-(3S,4S)-PYRROLIDINE-3,4-DIYLBIS(N- BENZYLBENZENESULFONAMIDE) | A,B | 2PQZ | 0.74 | |
ZYX | 4-(2-AMINOETHYL)BENZENESULFONAMIDE | A | 2NNG | 0.9 | |
263 | 1-(azidomethyl)-3-methylbenzene | X | 2RB2 | 0.71 | |
QN2 | N,N'-(3S,4S)-pyrrolidine-3,4-diylbis[N- (4-iodobenzyl)benzenesulfonamide] | A,B | 2QNP | 0.72 | |
271 | N-methyl-1-phenylmethanamine | X | 2RBT | 0.72 | |
BHY | N,N'-[biphenyl-4,4'-diyldi(2R)propane- 2,1-diyl]dimethanesulfonamide | A,B | 3BBR | 0.77 | |
WW7 | N-(6-AMINOHEXYL)-5-CHLORO-1-NAPHTHALENESULFONAMIDE | A | 1MUX | 0.71 | |
PTS | (4S-TRANS)-4-(AMINO)-5,6-DIHYDRO- 6-METHYL-4H-THIENO (2,3-B)THIOPYRAN- 2-SULFONAMIDE-7,7-DIOXIDE | A | 1CIM | 0.7 | |
HS4 | N-oxo-2-[(4-phenylphenyl)sulfonylamino]ethanamide | A | 3F17 | 0.72 | |
AMS | 3-MERCURI-4-AMINOBENZENESULFONAMIDE | A | 3CA2 | 0.71 |