Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02501679
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 |
I4B | ISOBUTYLBENZENE | A | 184L | 0.72 |  |
FPR | PROPYLBENZENE | C | 1RHK | 0.74 | |
BIH | NAPHTHALENE-2,6-DISULFONIC ACID | A | 1U4S | 0.76 | |
IBZ | 2-IODOBENZYLTHIO GROUP | A,B | 1CEL | 0.73 | |
B70 | tripotassium (1R)-4-biphenyl-4- yl-1-phosphonatobutane-1-sulfonate | A | 2ZCS | 0.73 | |
DMX | 3-[BENZYL(DIMETHYL)AMMONIO]PROPANE- 1-SULFONATE | A,B,C,D | 1TP7 | 0.73 | |
BPS | A,B | 2DE4 | 0.79 | | |
MBN | TOLUENE | A,B | 3D7O | 0.73 | |
| MBN | TOLUENE | A,B | 1R1X | 0.73 | |
| MBN | TOLUENE | A,B | 1JLX | 0.73 | |
| MBN | TOLUENE | A,B,C,D | 3D17 | 0.73 | |
| MBN | TOLUENE | A,B | 2VRL | 0.73 | |
| MBN | TOLUENE | A,I | 2Z3E | 0.73 | |
| MBN | TOLUENE | A,B | 1YZI | 0.73 | |
| MBN | TOLUENE | A,B | 2DN1 | 0.73 | |
| MBN | TOLUENE | A,B | 3EN1 | 0.73 | |
NTS | NAPHTHALENE TRISULFONATE | A | 1RML | 0.74 | |
OXE | ORTHO-XYLENE | A,B | 3E0X | 0.72 | |
| OXE | ORTHO-XYLENE | A | 188L | 0.72 | |
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 | |
N4B | N-BUTYLBENZENE | A | 186L | 0.74 | |
B69 | A | 2ZCR | 0.74 | | |
BBS | 4-TERT-BUTYLBENZENESULFONIC ACID | B | 1EOJ | 0.83 | |
| BBS | 4-TERT-BUTYLBENZENESULFONIC ACID | B | 1EOL | 0.83 | |
AES | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | A,B | 3B2Q | 0.74 | |
| AES | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | O,P,Q,R | 2B4T | 0.74 | |
| AES | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | O,P,Q,R | 2B4R | 0.74 | |
| AES | 4-(2-AMINOETHYL)BENZENESULFONYL FLUORIDE | A,B | 3EIU | 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 | |
PBA | PHENYLETHANE BORONIC ACID | C,G | 6CHA | 0.74 | |
PMB | PARA-MERCURY-BENZENESULFONIC ACID | B | 1BH9 | 0.73 | |
| PMB | PARA-MERCURY-BENZENESULFONIC ACID | H | 1HDK | 0.73 | |
| PMB | PARA-MERCURY-BENZENESULFONIC ACID | A | 1HJ1 | 0.73 | |
| PMB | PARA-MERCURY-BENZENESULFONIC ACID | A,B,C,D | 1YP2 | 0.73 | |
| PMB | PARA-MERCURY-BENZENESULFONIC ACID | A | 1XZC | 0.73 | |
MAJ | indane-5-sulfonamide | A | 2QOA | 0.76 | |
BNS | HYDROSULFONYLBENZENE | 1 | 1YYY | 0.75 | |
| BNS | HYDROSULFONYLBENZENE | A | 1MEM | 0.75 | |
| BNS | HYDROSULFONYLBENZENE | A,D,E | 1FH0 | 0.75 | |
| BNS | HYDROSULFONYLBENZENE | A,B,C,D | 1PQ9 | 0.75 | |