Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03786588
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 |
MAJ | indane-5-sulfonamide | A | 2QOA | 0.75 | |
FBA | 4-FLUOROBENZYLAMINE | B,D,E | 1AFQ | 0.7 | |
FBA | 4-FLUOROBENZYLAMINE | A | 1TNH | 0.7 | |
ZYX | 4-(2-AMINOETHYL)BENZENESULFONAMIDE | A | 2NNG | 0.92 | |
AES | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | A,B | 3B2Q | 0.94 | |
AES | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | O,P,Q,R | 2B4T | 0.94 | |
AES | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | O,P,Q,R | 2B4R | 0.94 | |
AES | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | A,B | 3EIU | 0.94 | |
EOA | N-PHENETHYL-FORMAMIDE | H,I | 1A5G | 0.72 | |
N2M | 5-AMINO-NAPHTALENE-2-MONOSULFONATE | C,D | 1HKN | 0.74 | |
F19 | 2-[(2-NAPHTHYLSULFONYL)AMINO]ETHYL DIHYDROGEN PHOSPHATE | A,B | 2CLO | 0.72 | |
F19 | 2-[(2-NAPHTHYLSULFONYL)AMINO]ETHYL DIHYDROGEN PHOSPHATE | A,B | 2CLH | 0.72 | |
TRJ | META-DI(AMINOMETHYL)BENZENE | A,I | 1GVV | 0.72 | |
TRJ | META-DI(AMINOMETHYL)BENZENE | A | 1FQ5 | 0.72 | |
AL5 | THIOPHENE-2,5-DISULFONIC ACID 2- AMIDE-5-(4-METHYL-BENZYLAMIDE) | A | 1BN1 | 0.71 | |
PO0 | 1-BENZYL-(R)-PROPYLAMINE | A,I | 1LZQ | 0.76 | |
PO0 | 1-BENZYL-(R)-PROPYLAMINE | B,I | 1M0B | 0.76 | |
TCK | N-[(1S)-5-amino-1-(chloroacetyl)pentyl]- 4-methylbenzenesulfonamide | A | 1ARC | 0.71 | |
TSU | PARA-TOLUENE SULFONATE | A,B | 1WUW | 0.82 | |
TSU | PARA-TOLUENE SULFONATE | A | 1B0D | 0.82 | |
NFP | 3-AMINO-5-PHENYLPENTANE | A | 1MEM | 0.74 | |
NFP | 3-AMINO-5-PHENYLPENTANE | A,D,E | 1FH0 | 0.74 | |
B2Y | 1-biphenyl-2-ylmethanamine | A,B,C,D | 3CCB | 0.7 | |
NBB | N-BUTYL-BENZENESULFONAMIDE | A,B | 3D73 | 0.79 | |
NBB | N-BUTYL-BENZENESULFONAMIDE | A | 3D77 | 0.79 | |
NBB | N-BUTYL-BENZENESULFONAMIDE | A,B | 3D78 | 0.79 | |
NBB | N-BUTYL-BENZENESULFONAMIDE | A,B | 3CZ1 | 0.79 | |
NBB | N-BUTYL-BENZENESULFONAMIDE | A | 3D75 | 0.79 | |
NBB | N-BUTYL-BENZENESULFONAMIDE | A | 3D76 | 0.79 | |
NBB | N-BUTYL-BENZENESULFONAMIDE | A | 3BJH | 0.79 | |
NBB | N-BUTYL-BENZENESULFONAMIDE | A,B | 3D74 | 0.79 | |
2AB | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 2OUA | 0.99 | |
2AB | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B,C,D | 2AJC | 0.99 | |
2AB | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 3PRO | 0.99 | |
2AB | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 2PFE | 0.99 | |
DMX | 3-[BENZYL(DIMETHYL)AMMONIO]PROPANE- 1-SULFONATE | A,B,C,D | 1TP7 | 0.74 | |
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 | |
TOS | P-SULFINOTOLUENE | H | 1ETT | 0.81 | |
TOS | P-SULFINOTOLUENE | I | 4PAD | 0.81 | |
TOS | P-SULFINOTOLUENE | A | 1EST | 0.81 | |
TOS | P-SULFINOTOLUENE | C,G | 2CHA | 0.81 | |
TOS | P-SULFINOTOLUENE | E | 1PPH | 0.81 | |
PPH | [(1R)-1-amino-2-phenylethyl]phosphonic acid | A | 1OS0 | 0.76 | |
PPH | [(1R)-1-amino-2-phenylethyl]phosphonic acid | E,I | 4TMN | 0.76 | |
PPH | [(1R)-1-amino-2-phenylethyl]phosphonic acid | S | 1CGH | 0.76 | |
UA5 | (4-ETHYLPHENYL)SULFAMIC ACID | A,B | 2I5X | 0.7 | |
BBS | 4-TERT-BUTYLBENZENESULFONIC ACID | B | 1EOJ | 0.8 | |
BBS | 4-TERT-BUTYLBENZENESULFONIC ACID | B | 1EOL | 0.8 | |
NAS | 2-NAPHTHALENESULFONIC ACID | I | 1QUR | 0.76 | |
NAS | 2-NAPHTHALENESULFONIC ACID | E,I | 1PPC | 0.76 | |
NAS | 2-NAPHTHALENESULFONIC ACID | H | 1ETS | 0.76 | |
ABN | BENZYLAMINE | D,H | 2HXC | 0.73 | |
ABN | BENZYLAMINE | A,I | 1A86 | 0.73 | |
ABN | BENZYLAMINE | A | 1UTN | 0.73 | |
ABN | BENZYLAMINE | A | 1N6X | 0.73 | |
ABN | BENZYLAMINE | A | 2BZA | 0.73 | |
ABN | BENZYLAMINE | A | 2EUS | 0.73 | |
ABN | BENZYLAMINE | A | 1N6Y | 0.73 | |
ABN | BENZYLAMINE | A | 1UTJ | 0.73 | |
PRA | 3-PHENYLPROPYLAMINE | A | 1TNK | 0.78 | |
PRA | 3-PHENYLPROPYLAMINE | M | 1UTL | 0.78 | |
PBN | 4-PHENYLBUTYLAMINE | A | 1TNI | 0.78 | |
PBN | 4-PHENYLBUTYLAMINE | A | 1UTP | 0.78 | |
BHY | N,N'-[biphenyl-4,4'-diyldi(2R)propane- 2,1-diyl]dimethanesulfonamide | A,B | 3BBR | 0.74 | |
HS4 | N-oxo-2-[(4-phenylphenyl)sulfonylamino]ethanamide | A | 3F17 | 0.73 | |
PMB | PARA-MERCURY-BENZENESULFONIC ACID | B | 1BH9 | 0.72 | |
PMB | PARA-MERCURY-BENZENESULFONIC ACID | H | 1HDK | 0.72 | |
PMB | PARA-MERCURY-BENZENESULFONIC ACID | A | 1HJ1 | 0.72 | |
PMB | PARA-MERCURY-BENZENESULFONIC ACID | A,B,C,D | 1YP2 | 0.72 | |
PMB | PARA-MERCURY-BENZENESULFONIC ACID | A | 1XZC | 0.72 | |
007 | 1-METHYLAMINE-1-BENZYL-CYCLOPENTANE | A,B,C,D | 2BUA | 0.72 | |
SMF | 4-SULFOMETHYL-L-PHENYLALANINE | D,H | 1O0D | 0.71 | |
SMF | 4-SULFOMETHYL-L-PHENYLALANINE | D,H | 2FES | 0.71 | |
SMF | 4-SULFOMETHYL-L-PHENYLALANINE | H,P | 2ANK | 0.71 | |
SMF | 4-SULFOMETHYL-L-PHENYLALANINE | D,H | 2FEQ | 0.71 | |
SMF | 4-SULFOMETHYL-L-PHENYLALANINE | H,P | 2A2X | 0.71 | |
SMF | 4-SULFOMETHYL-L-PHENYLALANINE | D,H | 1NZQ | 0.71 | |
TPA | TRANS-2-PHENYLCYCLOPROPYLAMINE | A | 1TNL | 0.73 | |
5NS | 5-aminonaphthalene-1-sulfonic acid | A,B | 3CFT | 0.72 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,C | 2AOI | 0.76 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOF | 0.76 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOJ | 0.76 | |
FRD | 1-PHENYL-2-AMINOPROPANE | A,B,C | 2AOH | 0.76 | |
PEA | 2-PHENYLETHYLAMINE | A,B,E,F,G,H | 1MHW | 0.79 | |
PEA | 2-PHENYLETHYLAMINE | A | 1TNJ | 0.79 | |
PEA | 2-PHENYLETHYLAMINE | D,H | 2HKM | 0.79 | |
PEA | 2-PHENYLETHYLAMINE | A | 1UTO | 0.79 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6Y | 0.79 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6Z | 0.79 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6U | 0.79 | |
PEA | 2-PHENYLETHYLAMINE | A | 1UTM | 0.79 | |
PMS | BENZYLSULFINIC ACID | B | 1PNM | 0.74 | |
PMS | BENZYLSULFINIC ACID | A,B | 1SH7 | 0.74 | |
PMS | BENZYLSULFINIC ACID | B,C | 1BB0 | 0.74 | |
PMS | BENZYLSULFINIC ACID | A,B | 1S2N | 0.74 | |
PMS | BENZYLSULFINIC ACID | A,B | 1WB8 | 0.74 | |
PMS | BENZYLSULFINIC ACID | A,B,C | 3CE4 | 0.74 | |
PMS | BENZYLSULFINIC ACID | A,B | 1Y9Z | 0.74 | |
PMS | BENZYLSULFINIC ACID | A | 3H18 | 0.74 | |
PMS | BENZYLSULFINIC ACID | A | 3H17 | 0.74 | |
PMS | BENZYLSULFINIC ACID | A | 2CBG | 0.74 | |
PMS | BENZYLSULFINIC ACID | A | 1SUP | 0.74 | |
PMS | BENZYLSULFINIC ACID | A,B | 1V6C | 0.74 | |
PMS | BENZYLSULFINIC ACID | A,B | 1WPR | 0.74 | |
PMS | BENZYLSULFINIC ACID | A,B | 1EQ9 | 0.74 | |
PMS | BENZYLSULFINIC ACID | A,B | 1AUR | 0.74 | |
PMS | BENZYLSULFINIC ACID | A | 1KLT | 0.74 | |
PMS | BENZYLSULFINIC ACID | B,C | 1CA8 | 0.74 | |
PMS | BENZYLSULFINIC ACID | A | 2GKO | 0.74 | |
PMS | BENZYLSULFINIC ACID | B,C,D | 1BA8 | 0.74 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBM | 0.83 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBD | 0.83 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1P06 | 0.83 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBI | 0.83 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 8LPR | 0.83 | |
BPS | A,B | 2DE4 | 0.77 | ||
SKF | 1,2,3,4-TETRAHYDRO-ISOQUINOLINE- 7-SULFONIC ACID AMIDE | A,B | 1HNN | 0.76 | |
AM4 | 4-(METHYLSULFONYL)BENZENECARBOXIMIDAMIDE | A | 1TX8 | 0.72 | |
BIH | NAPHTHALENE-2,6-DISULFONIC ACID | A | 1U4S | 0.74 | |
FTS | (3R)-3-(FLUOROMETHYL)-N-(3,3,3- TRIFLUOROPROPYL)-1,2,3,4-TETRAHYDROISOQUINOLINE- 7-SULFONAMIDE | A,B | 2G71 | 0.7 |