Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02251958
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 |
IBP | IBUPROFEN | A | 3FKX | 0.73 | |
IBP | IBUPROFEN | A,B | 2BXG | 0.73 | |
IBP | IBUPROFEN | A,B | 1EQG | 0.73 | |
IBP | IBUPROFEN | A,B,C | 2WD9 | 0.73 | |
IBP | IBUPROFEN | A | 2PWS | 0.73 | |
DIC | 3,4-DICHLOROISOCOUMARIN | A | 1DIC | 0.75 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K5S | 0.75 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1KEC | 0.75 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K7D | 0.75 | |
3BZ | 3-chlorobenzoate | X | 2QVZ | 0.72 | |
3BZ | 3-chlorobenzoate | X | 2QVX | 0.72 | |
791 | 2-PHENYLMALONIC ACID | A | 1O4P | 0.72 | |
NIU | 6,7,8,9-TETRAHYDRO-4-HYDROXY-3- (1-PHENYLPROPYL)CYCLOHEPTA[B]PYRAN- 2-ONE | A | 6UPJ | 0.71 | |
2CL | (2,6-DICHLOROPHENYL)ACETIC ACID | A | 2IPW | 0.8 | |
2CL | (2,6-DICHLOROPHENYL)ACETIC ACID | A | 2IS7 | 0.8 | |
LLG | 2-aminoethyl naphthalen-1-ylacetate | A | 3BC4 | 0.71 | |
174 | 4-CHLORO-BENZOIC ACID | X | 3DLP | 0.74 | |
174 | 4-CHLORO-BENZOIC ACID | X | 1T5D | 0.74 | |
BZM | BENZOIC ACID PHENYLMETHYLESTER | A,B | 1DZM | 0.77 | |
34C | (3-CHLORO-4-PROPOXY-PHENYL)-ACETIC ACID | A,B | 1HT8 | 0.71 | |
FLP | FLURBIPROFEN | A,B,C,D | 3PGH | 0.75 | |
FLP | FLURBIPROFEN | A,B | 1CQE | 0.75 | |
FLP | FLURBIPROFEN | A,B | 1EQH | 0.75 | |
FLP | FLURBIPROFEN | A,B | 2AYL | 0.75 | |
FLP | FLURBIPROFEN | A | 1DVT | 0.75 | |
FLP | FLURBIPROFEN | A | 1R9O | 0.75 | |
AFI | 2-[4-(4-CHLOROPHENYL)CYCLOHEXYLIDENE]- 3,4-DIHYDROXY-1(2H)-NAPHTHALENONE | A,B | 1UUM | 0.71 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A | 1OS0 | 0.71 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJI | 0.71 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJJ | 0.71 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2VS2 | 0.71 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 1OD1 | 0.71 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | E | 1EPR | 0.71 | |
PAC | 2-PHENYLACETIC ACID | B | 1PNL | 0.73 | |
PAC | 2-PHENYLACETIC ACID | B | 1K5Q | 0.73 | |
PAC | 2-PHENYLACETIC ACID | B | 1FXH | 0.73 | |
PAC | 2-PHENYLACETIC ACID | A | 2ISF | 0.73 | |
PAC | 2-PHENYLACETIC ACID | A | 2INE | 0.73 | |
5PV | 5-PHENYLVALERIC ACID | A,B | 2AY9 | 0.71 | |
BFL | A,B | 1Q4G | 0.77 | ||
OST | METHYL (2Z)-3-METHOXY-2-{2-[(E)- 2-PHENYLVINYL]PHENYL}ACRYLATE | C,D,E | 1SQQ | 0.8 | |
UIN | 5,6,7,8,9,10-HEXAHYDRO-4-HYDROXY- 3-(1-PHENYLPROPYL)CYCLOOCTA[B]PYRAN- 2-ONE | B | 5UPJ | 0.71 | |
973 | (5Z)-3-(4-CHLOROPHENYL)-4-HYDROXY- 5-(1-NAPHTHYLMETHYLENE)FURAN-2(5H)- ONE | A | 2Q85 | 0.78 | |
YRG | (2S)-2-(4-chlorophenoxy)-3-phenylpropanoic acid | A | 3CDP | 0.72 | |
34Z | 3,4-dichlorobenzoate | X | 2QVY | 0.72 | |
34Z | 3,4-dichlorobenzoate | X | 2QW0 | 0.72 | |
FL2 | FLURBIPROFEN METHYL ESTER | A,B | 1HT5 | 0.8 | |
IH5 | [4-(4-HYDROXY-3-ISOPROPYLPHENOXY)- 3,5-DIMETHYLPHENYL]ACETIC ACID | A | 1NAV | 0.7 | |
IH5 | [4-(4-HYDROXY-3-ISOPROPYLPHENOXY)- 3,5-DIMETHYLPHENYL]ACETIC ACID | A | 1NAX | 0.7 | |
DFA | DIPHENYLACETIC ACID | A,B,C | 1GMY | 0.78 | |
HSI | (3R)-3-{4-[(4-CHLOROPHENYL)ETHYNYL]BENZOYL}NONANOIC ACID | A | 2Z2D | 0.75 | |
NLA | NAPHTHALEN-1-YL-ACETIC ACID | A,B,C,D | 1LRH | 0.72 | |
NLA | NAPHTHALEN-1-YL-ACETIC ACID | B | 2P1O | 0.72 |