Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02874191
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 |
FL2 | FLURBIPROFEN METHYL ESTER | A,B | 1HT5 | 0.72 |  |
173 | BENZOYL-FORMIC ACID | A,B | 1SZE | 0.73 | |
OPH | 2-HYDROXY-3-PHENYL-PROPIONIC ACID METHYL ESTER | E,I | 1PPM | 0.71 | |
| OPH | 2-HYDROXY-3-PHENYL-PROPIONIC ACID METHYL ESTER | E,I | 1PPL | 0.71 | |
CLT | 4-PHENYL-BUTANOIC ACID | A | 1THL | 0.75 | |
| CLT | 4-PHENYL-BUTANOIC ACID | A,B | 2AY7 | 0.75 | |
| CLT | 4-PHENYL-BUTANOIC ACID | E,I | 1TMN | 0.75 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MRA | 0.74 | |
| APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MNS | 0.74 | |
| APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1DTN | 0.74 | |
| APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MDR | 0.74 | |
IBP | IBUPROFEN | A | 3FKX | 0.74 | |
| IBP | IBUPROFEN | A,B | 2BXG | 0.74 | |
| IBP | IBUPROFEN | A,B | 1EQG | 0.74 | |
| IBP | IBUPROFEN | A,B,C | 2WD9 | 0.74 | |
| IBP | IBUPROFEN | A | 2PWS | 0.74 | |
HCI | HYDROCINNAMIC ACID | A,B | 1BXG | 0.74 | |
| HCI | HYDROCINNAMIC ACID | A,B | 1TOG | 0.74 | |
| HCI | HYDROCINNAMIC ACID | A,B | 1V2F | 0.74 | |
| HCI | HYDROCINNAMIC ACID | A,B | 1AHX | 0.74 | |
| HCI | HYDROCINNAMIC ACID | A | 1TOI | 0.74 | |
| HCI | HYDROCINNAMIC ACID | A,B | 1AY8 | 0.74 | |
| HCI | HYDROCINNAMIC ACID | A | 1TOJ | 0.74 | |
CPM | S-(2-CARBOXY-3-PHENYLPROPYL)THIODIIMINE- S-METHANE | A | 1CPS | 0.78 | |
PPT | 3-(P-TOLYL)PROPIONIC ACID | A,B | 2AY4 | 0.75 | |
5PV | 5-PHENYLVALERIC ACID | A,B | 2AY9 | 0.75 | |
BNA | BIS-(NAPHTHYL-1-METHYL) ACETIC ACID | I | 4ER1 | 0.73 | |
| BNA | BIS-(NAPHTHYL-1-METHYL) ACETIC ACID | A | 1FQ5 | 0.73 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A | 1OS0 | 0.75 | |
| DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJI | 0.75 | |
| DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJJ | 0.75 | |
| DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2VS2 | 0.75 | |
| DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 1OD1 | 0.75 | |
| DPH | DEAMINO-METHYL-PHENYLALANINE | E | 1EPR | 0.75 | |
BIP | 2-BENZYL-3-IODOPROPANOIC ACID | A,B,C,D | 1BAV | 0.72 | |
M28 | 3-[4-(AMINOSULFONYL)PHENYL]PROPANOIC ACID | A,B | 2NN1 | 0.74 | |
| M28 | 3-[4-(AMINOSULFONYL)PHENYL]PROPANOIC ACID | A | 2NNO | 0.74 | |
BTP | 2-THIOMETHYL-3-PHENYLPROPANOIC ACID | A,B | 1JAO | 0.77 | |
ISA | 3-(4-IODO-PHENYL)-2-MERCAPTO-PROPIONIC ACID | A | 1NX3 | 0.74 | |
| ISA | 3-(4-IODO-PHENYL)-2-MERCAPTO-PROPIONIC ACID | A,B | 1ALW | 0.74 | |
OSB | 2-SUCCINYLBENZOATE | A | 1FHV | 0.7 | |
| OSB | 2-SUCCINYLBENZOATE | A,B,C,D | 1SJB | 0.7 | |
| OSB | 2-SUCCINYLBENZOATE | A,B | 2QVH | 0.7 | |
ELI | 6-(3-METHYL-1,4-DIOXO-1,4-DIHYDRONAPHTHALEN- 2-YL)HEXANOIC ACID | A,B | 2GH5 | 0.75 | |
M5P | (S)-2-(MERCAPTOMETHYL)-5-PHENYLPENTANOIC ACID | A,B | 2YZ3 | 0.76 | |
BFL | A,B | 1Q4G | 0.78 | | |
791 | 2-PHENYLMALONIC ACID | A | 1O4P | 0.71 | |
FLP | FLURBIPROFEN | A,B,C,D | 3PGH | 0.76 | |
| FLP | FLURBIPROFEN | A,B | 1CQE | 0.76 | |
| FLP | FLURBIPROFEN | A,B | 1EQH | 0.76 | |
| FLP | FLURBIPROFEN | A,B | 2AYL | 0.76 | |
| FLP | FLURBIPROFEN | A | 1DVT | 0.76 | |
| FLP | FLURBIPROFEN | A | 1R9O | 0.76 | |
PPY | 3-PHENYLPYRUVIC ACID | A,B | 2Q5O | 0.79 | |
| PPY | 3-PHENYLPYRUVIC ACID | A,B | 1LCO | 0.79 | |
| PPY | 3-PHENYLPYRUVIC ACID | A,B,C,D,E,F | 2ZF4 | 0.79 | |
| PPY | 3-PHENYLPYRUVIC ACID | A,B | 1BW9 | 0.79 | |
TRZ | TRAZEOLIDE | A | 1C12 | 0.7 | |
156 | 4-[3-OXO-3-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL)-PROPENYL]-BENZOIC ACID | A | 1FCZ | 0.71 | |
PAC | 2-PHENYLACETIC ACID | B | 1PNL | 0.74 | |
| PAC | 2-PHENYLACETIC ACID | B | 1K5Q | 0.74 | |
| PAC | 2-PHENYLACETIC ACID | B | 1FXH | 0.74 | |
| PAC | 2-PHENYLACETIC ACID | A | 2ISF | 0.74 | |
| PAC | 2-PHENYLACETIC ACID | A | 2INE | 0.74 | |
RP4 | (1S,4S,5S)-1,4,5-TRIHYDROXY-3-[3- (PHENYLTHIO)PHENYL]CYCLOHEX-2-ENE- 1-CARBOXYLIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 2CJF | 0.74 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | 0,1,3,4,5,9, A,B,C,H,J,K, L,M,N,O,Q,R, S,T,U,Y,Z | 1VQ6 | 0.71 | |
| HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | A,B | 1C1X | 0.71 | |
| HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | 0,1,3,4,9,A, B,C,D,F,H,J, K,L,M,N,O,Q, R,S,T,U,Y,Z | 1VQP | 0.71 | |
| HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | 0,1,2,3,4,5, 9,A,B,C,D,F, H,J,K,L,M,N, O,Q,R,S,T,U, Y,Z | 1VQN | 0.71 | |
| HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1QRP | 0.71 | |
| HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | A | 2CTC | 0.71 | |
| HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1E82 | 0.71 | |
| HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1E81 | 0.71 | |
AN1 | 3-(10-METHYL-ANTHRACEN-9-YL)-PROPIONIC ACID | H,Y | 1LO3 | 0.75 | |
KPV | 5-PHENYL-2-KETO-VALERIC ACID | A,B | 2Q5Q | 0.79 | |
ISF | A,B | 1PGE | 0.76 | | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K5S | 0.76 | |
| GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1KEC | 0.76 | |
| GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K7D | 0.76 | |
256 | PHENYL(SULFO)ACETIC ACID | A | 1O4Q | 0.72 | |
DFA | DIPHENYLACETIC ACID | A,B,C | 1GMY | 0.78 | |
EMT | 2-(ETHYLMERCURI-THIO)-BENZOIC ACID | A,B | 1KDG | 0.72 | |
| EMT | 2-(ETHYLMERCURI-THIO)-BENZOIC ACID | A,B,C,D | 1O9L | 0.72 | |
BZS | L-BENZYLSUCCINIC ACID | A | 1CBX | 0.72 | |
| BZS | L-BENZYLSUCCINIC ACID | A | 1HYT | 0.72 | |
| BZS | L-BENZYLSUCCINIC ACID | A,B | 1WHT | 0.72 | |
NLA | NAPHTHALEN-1-YL-ACETIC ACID | A,B,C,D | 1LRH | 0.77 | |
| NLA | NAPHTHALEN-1-YL-ACETIC ACID | B | 2P1O | 0.77 | |