Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02336496
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 |
BPA![]() | 7S,8R,9R-TRIHYDROXY-7,8,9,10-TETRAHYDRO BENZO[A]PYRENE | A | 1JDG | 0.72 | ![]() |
NPY![]() | NAPHTHALENE | A,B | 1O7G | 0.84 | ![]() |
KTP![]() | (2-NAPHTHALEN-2-YL-1-NAPHTHALEN- 1-YL-2-OXO-ETHYL)-PHOSPHONIC ACID | A,B | 1KYN | 0.71 | ![]() |
BDB![]() | A,B | 1KE3 | 0.74 | ![]() | |
OXE![]() | ORTHO-XYLENE | A,B | 3E0X | 0.73 | ![]() |
OXE![]() | ORTHO-XYLENE | A | 188L | 0.73 | ![]() |
TBC![]() | (9S,10R)-9-HYDROXY-7,8,9,10-TETRAHYDROBENZO[A]PYRENE | A | 1N8C | 0.8 | ![]() |
TTA![]() | TETRAPHENYL-ARSONIUM | A | 1HYV | 0.76 | ![]() |
BNA![]() | BIS-(NAPHTHYL-1-METHYL) ACETIC ACID | I | 4ER1 | 0.73 | ![]() |
BNA![]() | BIS-(NAPHTHYL-1-METHYL) ACETIC ACID | A | 1FQ5 | 0.73 | ![]() |
PYL![]() | PHENYLETHANE | C | 1B07 | 0.71 | ![]() |
PYL![]() | PHENYLETHANE | A,B | 2VRM | 0.71 | ![]() |
PYL![]() | PHENYLETHANE | A | 1NHB | 0.71 | ![]() |
BAP![]() | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1AXV | 0.72 | ![]() |
BAP![]() | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A,E | 2IBK | 0.72 | ![]() |
BAP![]() | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A,B,C,D,E,F | 2IA6 | 0.72 | ![]() |
BAP![]() | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1Y9H | 0.72 | ![]() |
BAP![]() | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1FYY | 0.72 | ![]() |
BAP![]() | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1AXO | 0.72 | ![]() |
BAP![]() | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1DXA | 0.72 | ![]() |
BAP![]() | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1AXL | 0.72 | ![]() |
BAP![]() | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A,B,D,E,F | 1S0M | 0.72 | ![]() |
BAP![]() | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A | 1BPS | 0.72 | ![]() |
BAP![]() | 1,2,3-TRIHYDROXY-1,2,3,4-TETRAHYDROBENZO[A]PYRENE | A,C | 1XC9 | 0.72 | ![]() |
N4B![]() | N-BUTYLBENZENE | A | 186L | 0.71 | ![]() |
118![]() | TETRAPHENYLANTIMONIUM ION | A | 1EXI | 0.76 | ![]() |
PXY![]() | PARA-XYLENE | A | 187L | 0.71 | ![]() |
PXY![]() | PARA-XYLENE | A | 225L | 0.71 | ![]() |
PEY![]() | PHENANTHRENE | A,B | 2HML | 0.92 | ![]() |
PEY![]() | PHENANTHRENE | A,B | 2HMK | 0.92 | ![]() |
I4B![]() | ISOBUTYLBENZENE | A | 184L | 0.71 | ![]() |
AN3![]() | ANTHRACENE | A,B | 2HMN | 0.92 | ![]() |
AN3![]() | ANTHRACENE | A,B | 2HMM | 0.92 | ![]() |
FNP![]() | {[7-(DIFLUORO-PHOSPHONO-METHYL)- NAPHTHALEN-2-YL]-DIFLUORO-METHYL}- PHOSPHONIC ACID | A | 1KAK | 0.72 | ![]() |
AN1![]() | 3-(10-METHYL-ANTHRACEN-9-YL)-PROPIONIC ACID | H,Y | 1LO3 | 0.72 | ![]() |
1PB![]() | 1,4-DIPHENYL-2-BUTENE | A,B | 1OJ9 | 0.78 | ![]() |
DEN![]() | INDENE | A | 183L | 0.71 | ![]() |
FPR![]() | PROPYLBENZENE | C | 1RHK | 0.71 | ![]() |
P4P![]() | TETRAPHENYLPHOSPHONIUM | A,M | 1EXJ | 0.73 | ![]() |
P4P![]() | TETRAPHENYLPHOSPHONIUM | A,C | 3B62 | 0.73 | ![]() |
P4P![]() | TETRAPHENYLPHOSPHONIUM | A,B | 1R8E | 0.73 | ![]() |
P4P![]() | TETRAPHENYLPHOSPHONIUM | A | 2BOW | 0.73 | ![]() |
P4P![]() | TETRAPHENYLPHOSPHONIUM | A | 3B5D | 0.73 | ![]() |
745![]() | TRANS-6-(2-PHENYLCYCLOPROPYL)-NAPHTHALENE- 2-CARBOXAMIDINE | A | 1U6Q | 0.71 | ![]() |