Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02247790
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 |
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 | |
PRA | 3-PHENYLPROPYLAMINE | A | 1TNK | 0.71 | |
PRA | 3-PHENYLPROPYLAMINE | M | 1UTL | 0.71 | |
TSU | PARA-TOLUENE SULFONATE | A,B | 1WUW | 0.79 | |
TSU | PARA-TOLUENE SULFONATE | A | 1B0D | 0.79 | |
PBN | 4-PHENYLBUTYLAMINE | A | 1TNI | 0.71 | |
PBN | 4-PHENYLBUTYLAMINE | A | 1UTP | 0.71 | |
2AB | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 2OUA | 0.81 | |
2AB | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B,C,D | 2AJC | 0.81 | |
2AB | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 3PRO | 0.81 | |
2AB | 4-(2-AMINOETHYL)BENZENESULFONIC ACID | A,B | 2PFE | 0.81 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBM | 0.72 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBD | 0.72 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1P06 | 0.72 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 1GBI | 0.72 | |
B2F | PHENYLALANINE BORONIC ACID | A,P | 8LPR | 0.72 | |
MAJ | indane-5-sulfonamide | A | 2QOA | 0.89 | |
BIH | NAPHTHALENE-2,6-DISULFONIC ACID | A | 1U4S | 0.76 | |
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 | |
TLD | 4-methylbenzene-1,2-dithiol | A | 2Z94 | 0.74 | |
BNS | HYDROSULFONYLBENZENE | 1 | 1YYY | 0.71 | |
BNS | HYDROSULFONYLBENZENE | A | 1MEM | 0.71 | |
BNS | HYDROSULFONYLBENZENE | A,D,E | 1FH0 | 0.71 | |
BNS | HYDROSULFONYLBENZENE | A,B,C,D | 1PQ9 | 0.71 | |
PMS | BENZYLSULFINIC ACID | B | 1PNM | 0.71 | |
PMS | BENZYLSULFINIC ACID | A,B | 1SH7 | 0.71 | |
PMS | BENZYLSULFINIC ACID | B,C | 1BB0 | 0.71 | |
PMS | BENZYLSULFINIC ACID | A,B | 1S2N | 0.71 | |
PMS | BENZYLSULFINIC ACID | A,B | 1WB8 | 0.71 | |
PMS | BENZYLSULFINIC ACID | A,B,C | 3CE4 | 0.71 | |
PMS | BENZYLSULFINIC ACID | A,B | 1Y9Z | 0.71 | |
PMS | BENZYLSULFINIC ACID | A | 3H18 | 0.71 | |
PMS | BENZYLSULFINIC ACID | A | 3H17 | 0.71 | |
PMS | BENZYLSULFINIC ACID | A | 2CBG | 0.71 | |
PMS | BENZYLSULFINIC ACID | A | 1SUP | 0.71 | |
PMS | BENZYLSULFINIC ACID | A,B | 1V6C | 0.71 | |
PMS | BENZYLSULFINIC ACID | A,B | 1WPR | 0.71 | |
PMS | BENZYLSULFINIC ACID | A,B | 1EQ9 | 0.71 | |
PMS | BENZYLSULFINIC ACID | A,B | 1AUR | 0.71 | |
PMS | BENZYLSULFINIC ACID | A | 1KLT | 0.71 | |
PMS | BENZYLSULFINIC ACID | B,C | 1CA8 | 0.71 | |
PMS | BENZYLSULFINIC ACID | A | 2GKO | 0.71 | |
PMS | BENZYLSULFINIC ACID | B,C,D | 1BA8 | 0.71 | |
WW7 | N-(6-AMINOHEXYL)-5-CHLORO-1-NAPHTHALENESULFONAMIDE | A | 1MUX | 0.72 | |
NTS | NAPHTHALENE TRISULFONATE | A | 1RML | 0.74 | |
PEA | 2-PHENYLETHYLAMINE | A,B,E,F,G,H | 1MHW | 0.7 | |
PEA | 2-PHENYLETHYLAMINE | A | 1TNJ | 0.7 | |
PEA | 2-PHENYLETHYLAMINE | D,H | 2HKM | 0.7 | |
PEA | 2-PHENYLETHYLAMINE | A | 1UTO | 0.7 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6Y | 0.7 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6Z | 0.7 | |
PEA | 2-PHENYLETHYLAMINE | A,B | 1D6U | 0.7 | |
PEA | 2-PHENYLETHYLAMINE | A | 1UTM | 0.7 | |
OXE | ORTHO-XYLENE | A,B | 3E0X | 0.72 | |
OXE | ORTHO-XYLENE | A | 188L | 0.72 | |
SKF | 1,2,3,4-TETRAHYDRO-ISOQUINOLINE- 7-SULFONIC ACID AMIDE | A,B | 1HNN | 0.77 | |
FTS | (3R)-3-(FLUOROMETHYL)-N-(3,3,3- TRIFLUOROPROPYL)-1,2,3,4-TETRAHYDROISOQUINOLINE- 7-SULFONAMIDE | A,B | 2G71 | 0.71 | |
BBS | 4-TERT-BUTYLBENZENESULFONIC ACID | B | 1EOJ | 0.8 | |
BBS | 4-TERT-BUTYLBENZENESULFONIC ACID | B | 1EOL | 0.8 | |
F19 | 2-[(2-NAPHTHYLSULFONYL)AMINO]ETHYL DIHYDROGEN PHOSPHATE | A,B | 2CLO | 0.76 | |
F19 | 2-[(2-NAPHTHYLSULFONYL)AMINO]ETHYL DIHYDROGEN PHOSPHATE | A,B | 2CLH | 0.76 | |
FBU | 3,5-DIFLUOROBENZENESULFONAMIDE | A | 1IF6 | 0.71 | |
FBT | 2,6-DIFLUOROBENZENESULFONAMIDE | A | 1IF5 | 0.71 | |
M25 | N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDE | A,B | 2NMX | 0.77 | |
M25 | N-{2-[4-(AMINOSULFONYL)PHENYL]ETHYL}ACETAMIDE | A | 2NNS | 0.77 | |
M28 | 3-[4-(AMINOSULFONYL)PHENYL]PROPANOIC ACID | A,B | 2NN1 | 0.71 | |
M28 | 3-[4-(AMINOSULFONYL)PHENYL]PROPANOIC ACID | A | 2NNO | 0.71 | |
3CC | N-[(2R)-5-(aminosulfonyl)-2,3-dihydro- 1H-inden-2-yl]-2-propylpentanamide | A | 2QO8 | 0.72 | |
BPS | A,B | 2DE4 | 0.75 | ||
AL5 | THIOPHENE-2,5-DISULFONIC ACID 2- AMIDE-5-(4-METHYL-BENZYLAMIDE) | A | 1BN1 | 0.7 | |
NDT | 2-(TOLUENE-4-SULFONYL)-2H-BENZO[D][1,2,3]DIAZABORININ- 1-OL | A,B | 1DFG | 0.71 | |
HS7 | N-oxo-2-(phenylsulfonylamino)ethanamide | A | 3F1A | 0.71 | |
TCK | N-[(1S)-5-amino-1-(chloroacetyl)pentyl]- 4-methylbenzenesulfonamide | A | 1ARC | 0.7 | |
HS4 | N-oxo-2-[(4-phenylphenyl)sulfonylamino]ethanamide | A | 3F17 | 0.78 | |
FBS | 4-FLOUROBENZENESULFONAMIDE | A | 1IF4 | 0.73 | |
BHY | N,N'-[biphenyl-4,4'-diyldi(2R)propane- 2,1-diyl]dimethanesulfonamide | A,B | 3BBR | 0.72 | |
AES | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | A,B | 3B2Q | 0.85 | |
AES | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | O,P,Q,R | 2B4T | 0.85 | |
AES | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | O,P,Q,R | 2B4R | 0.85 | |
AES | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | A,B | 3EIU | 0.85 | |
TOS | P-SULFINOTOLUENE | H | 1ETT | 0.78 | |
TOS | P-SULFINOTOLUENE | I | 4PAD | 0.78 | |
TOS | P-SULFINOTOLUENE | A | 1EST | 0.78 | |
TOS | P-SULFINOTOLUENE | C,G | 2CHA | 0.78 | |
TOS | P-SULFINOTOLUENE | E | 1PPH | 0.78 | |
ZYX | 4-(2-AMINOETHYL)BENZENESULFONAMIDE | A | 2NNG | 0.87 | |
AM4 | 4-(METHYLSULFONYL)BENZENECARBOXIMIDAMIDE | A | 1TX8 | 0.7 | |
M29 | ETHYL 3-[4-(AMINOSULFONYL)PHENYL]PROPANOATE | A | 2NNV | 0.72 | |
M29 | ETHYL 3-[4-(AMINOSULFONYL)PHENYL]PROPANOATE | A,B | 2NN7 | 0.72 |