Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02860340
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 |
23N | (2R)-2-benzyl-3-nitropropanoic acid | A | 2RFH | 0.72 | |
NHL | (4S)-4-(2-NAPHTHYLMETHYL)-D-GLUTAMIC ACID | A | 2OHV | 0.82 | |
528 | (2S)-2-[3-(AMINOMETHYL)PHENYL]- 3-{(R)-HYDROXY[(1R)-2-METHYL-1- {[(3-PHENYLPROPYL)SULFONYL]AMINO}PROPYL]PHOSPHORYL}PROPANOIC ACID | A,B,C | 2PIY | 0.7 | |
AN1 | 3-(10-METHYL-ANTHRACEN-9-YL)-PROPIONIC ACID | H,Y | 1LO3 | 0.81 | |
791 | 2-PHENYLMALONIC ACID | A | 1O4P | 0.72 | |
1PA | PHENYLMETHYLACETIC ACID ALANINE | I | 1BHF | 0.73 | |
BJP | (1R)-2-PHENYLACETAMIDO-2-(3-CARBOXYPHENYL)ETHYL BORONIC ACID | A | 1ERO | 0.73 | |
BFL | A,B | 1Q4G | 0.79 | ||
HPI | N-(1-CARBOXY-3-PHENYLPROPYL)PHENYLALANYL- ALPHA-ASPARAGINE | A | 1U4G | 0.7 | |
4PH | 4-methyl-L-phenylalanine | B,C | 3BV9 | 0.72 | |
DPN | D-PHENYLALANINE | P | 1MCS | 0.7 | |
DPN | D-PHENYLALANINE | A | 1GOE | 0.7 | |
DPN | D-PHENYLALANINE | A | 2RM9 | 0.7 | |
DPN | D-PHENYLALANINE | A | 1SOC | 0.7 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1SFQ | 0.7 | |
DPN | D-PHENYLALANINE | I | 1ABJ | 0.7 | |
DPN | D-PHENYLALANINE | P | 1DWE | 0.7 | |
DPN | D-PHENYLALANINE | I,M | 1HLT | 0.7 | |
DPN | D-PHENYLALANINE | A,H,L | 1J9C | 0.7 | |
DPN | D-PHENYLALANINE | I,T | 1TMB | 0.7 | |
DPN | D-PHENYLALANINE | A | 2JRY | 0.7 | |
DPN | D-PHENYLALANINE | A | 2SOC | 0.7 | |
DPN | D-PHENYLALANINE | A | 2YYF | 0.7 | |
DPN | D-PHENYLALANINE | I | 2HGT | 0.7 | |
DPN | D-PHENYLALANINE | A,D | 2Q3I | 0.7 | |
DPN | D-PHENYLALANINE | A,P | 1MCD | 0.7 | |
DPN | D-PHENYLALANINE | P | 1HAO | 0.7 | |
DPN | D-PHENYLALANINE | A,B,I | 1Z8J | 0.7 | |
DPN | D-PHENYLALANINE | A,B,C | 2PGQ | 0.7 | |
DPN | D-PHENYLALANINE | C,D,H,I,L,M, X,Y | 1DVA | 0.7 | |
DPN | D-PHENYLALANINE | P | 1NRR | 0.7 | |
DPN | D-PHENYLALANINE | I | 1PPB | 0.7 | |
DPN | D-PHENYLALANINE | C,D,G,H | 1NU7 | 0.7 | |
DPN | D-PHENYLALANINE | I | 2HPP | 0.7 | |
DPN | D-PHENYLALANINE | B,C | 2OD3 | 0.7 | |
DPN | D-PHENYLALANINE | A | 1B0Q | 0.7 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1NU9 | 0.7 | |
DPN | D-PHENYLALANINE | A,B,I | 1Z8I | 0.7 | |
DPN | D-PHENYLALANINE | H,I,J | 1TMU | 0.7 | |
DPN | D-PHENYLALANINE | A,B,C,D,E,F | 2DNS | 0.7 | |
DPN | D-PHENYLALANINE | A | 1GO9 | 0.7 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1A0H | 0.7 | |
DPN | D-PHENYLALANINE | P | 1MCF | 0.7 | |
DPN | D-PHENYLALANINE | A | 2RME | 0.7 | |
DPN | D-PHENYLALANINE | H,I | 1TMT | 0.7 | |
DPN | D-PHENYLALANINE | I | 1ABI | 0.7 | |
DPN | D-PHENYLALANINE | R | 1NRQ | 0.7 | |
DPN | D-PHENYLALANINE | B,C,F,G | 2A1D | 0.7 | |
DPN | D-PHENYLALANINE | A,B | 2Q33 | 0.7 | |
DPN | D-PHENYLALANINE | C,H,L | 1DAN | 0.7 | |
DPN | D-PHENYLALANINE | P | 1MCE | 0.7 | |
DPN | D-PHENYLALANINE | B,C,E,F | 2A45 | 0.7 | |
DPN | D-PHENYLALANINE | A | 2RMI | 0.7 | |
DPN | D-PHENYLALANINE | A,B,I | 1TQ7 | 0.7 | |
DPN | D-PHENYLALANINE | A | 1W7M | 0.7 | |
DPN | D-PHENYLALANINE | P | 1HAP | 0.7 | |
DPN | D-PHENYLALANINE | A,B | 1ORF | 0.7 | |
DPN | D-PHENYLALANINE | I | 1IHS | 0.7 | |
DPN | D-PHENYLALANINE | P | 1MCC | 0.7 | |
DPN | D-PHENYLALANINE | A | 2RMD | 0.7 | |
DPN | D-PHENYLALANINE | A | 2JQB | 0.7 | |
DPN | D-PHENYLALANINE | I | 2HPQ | 0.7 | |
DPN | D-PHENYLALANINE | C,E,F | 1SHH | 0.7 | |
DPN | D-PHENYLALANINE | A,I | 1CVR | 0.7 | |
DPN | D-PHENYLALANINE | L,P | 1AUT | 0.7 | |
DPN | D-PHENYLALANINE | P | 1MCI | 0.7 | |
DPN | D-PHENYLALANINE | H,I | 3F6U | 0.7 | |
DPN | D-PHENYLALANINE | A | 1BFW | 0.7 | |
DPN | D-PHENYLALANINE | H,I | 1HAI | 0.7 | |
DPN | D-PHENYLALANINE | B,C | 2THF | 0.7 | |
DPN | D-PHENYLALANINE | I | 1IHT | 0.7 | |
DPN | D-PHENYLALANINE | A,P | 1MCJ | 0.7 | |
DPN | D-PHENYLALANINE | A | 1TKH | 0.7 | |
DPN | D-PHENYLALANINE | C,H,L,T | 2FIR | 0.7 | |
DPN | D-PHENYLALANINE | A | 2FMZ | 0.7 | |
DPN | D-PHENYLALANINE | A | 1YL9 | 0.7 | |
DPN | D-PHENYLALANINE | I | 1HUT | 0.7 | |
DPN | D-PHENYLALANINE | I | 1FXY | 0.7 | |
DPN | D-PHENYLALANINE | A | 1YL8 | 0.7 | |
DPN | D-PHENYLALANINE | C,H,L | 1QFK | 0.7 | |
DPN | D-PHENYLALANINE | P | 1MCB | 0.7 | |
TTB | 4-[(1E)-2-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRONAPHTHALEN-2- YL)PROP-1-ENYL]BENZOIC ACID | A | 1XAP | 0.74 | |
PG9 | D-PHENYLGLYCINE | A,B,G,H | 10GS | 0.72 | |
PG9 | D-PHENYLGLYCINE | A,B,C,D | 2B4K | 0.72 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A | 1OS0 | 0.73 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJI | 0.73 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJJ | 0.73 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2VS2 | 0.73 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 1OD1 | 0.73 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | E | 1EPR | 0.73 | |
ZAE | N-methyl-D-phenylalanine | H,I,R | 1TBZ | 0.72 | |
HPE | HOMOPHENYLALANINE | A,B | 1B1H | 0.72 | |
HOP | (1S,2S,5S)2-(4-GLUTARIDYLBENZYL)- 5-PHENYL-1-CYCLOHEXANOL | H,L | 1D6V | 0.73 | |
HOP | (1S,2S,5S)2-(4-GLUTARIDYLBENZYL)- 5-PHENYL-1-CYCLOHEXANOL | A,B,H,L | 1AXS | 0.73 | |
HMF | 2-AMINO-4-PHENYL-BUTYRIC ACID | I,J | 1AY6 | 0.72 | |
MPQ | N-METHYL-ALPHA-PHENYL-GLYCINE | D | 1D6E | 0.73 | |
BIF | (R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID | G,M,P,S | 1YYL | 0.74 | |
BIF | (R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID | G,M,P,S | 2I5Y | 0.74 | |
PBF | PARA-(BENZOYL)-PHENYLALANINE | A | 2FR9 | 0.71 | |
PBF | PARA-(BENZOYL)-PHENYLALANINE | A,B | 1EEN | 0.71 | |
PBF | PARA-(BENZOYL)-PHENYLALANINE | A | 2HGZ | 0.71 | |
PBF | PARA-(BENZOYL)-PHENYLALANINE | A | 2FRB | 0.71 | |
ELI | 6-(3-METHYL-1,4-DIOXO-1,4-DIHYDRONAPHTHALEN- 2-YL)HEXANOIC ACID | A,B | 2GH5 | 0.71 | |
FL2 | FLURBIPROFEN METHYL ESTER | A,B | 1HT5 | 0.73 | |
156 | 4-[3-OXO-3-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL)-PROPENYL]-BENZOIC ACID | A | 1FCZ | 0.73 | |
NAL | BETA-(2-NAPHTHYL)-ALANINE | A,B | 2ITK | 0.79 | |
NAL | BETA-(2-NAPHTHYL)-ALANINE | H,I | 4THN | 0.79 | |
NAL | BETA-(2-NAPHTHYL)-ALANINE | A,B | 2Q5A | 0.79 | |
NAL | BETA-(2-NAPHTHYL)-ALANINE | A | 1ZWU | 0.79 | |
NAL | BETA-(2-NAPHTHYL)-ALANINE | A | 1SKL | 0.79 | |
NAL | BETA-(2-NAPHTHYL)-ALANINE | H,I | 5GDS | 0.79 | |
NAL | BETA-(2-NAPHTHYL)-ALANINE | A | 1ZH0 | 0.79 | |
NAL | BETA-(2-NAPHTHYL)-ALANINE | A,B | 2JT9 | 0.79 | |
IBP | IBUPROFEN | A | 3FKX | 0.77 | |
IBP | IBUPROFEN | A,B | 2BXG | 0.77 | |
IBP | IBUPROFEN | A,B | 1EQG | 0.77 | |
IBP | IBUPROFEN | A,B,C | 2WD9 | 0.77 | |
IBP | IBUPROFEN | A | 2PWS | 0.77 | |
059 | (2S)-2-[3-(AMINOMETHYL)PHENYL]- 3-{(S)-HYDROXY[(1R)-2-METHYL-1- {[(2-PHENYLETHYL)SULFONYL]AMINO}PROPYL]PHOSPHORYL}PROPANOIC ACID | A | 2PJ6 | 0.71 | |
564 | 6-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTALENE-2-CARBONYL)- NAPHTALENE-2-CARBOXYLIC ACID | A | 1FCY | 0.73 | |
LOB | LOBELINE | A,B,C,D,E,F, G,H,I,J | 2BYS | 0.71 | |
OIN | (1R,5S)-8-METHYL-8-AZABICYCLO[3.2.1]OCT- 3-YL (2R)-3-HYDROXY-2-PHENYLPROPANOATE | A | 1TH6 | 0.75 | |
OIN | (1R,5S)-8-METHYL-8-AZABICYCLO[3.2.1]OCT- 3-YL (2R)-3-HYDROXY-2-PHENYLPROPANOATE | A | 2ARM | 0.75 | |
MN7 | 1-CARBOXY-4-ISOBUTYLAMINOMETHYLBENZENE | N | 1NLO | 0.7 | |
FRF | PHE-REDUCED-PHE | A,I | 1GVX | 0.73 | |
184 | 6-[HYDROXY-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTALEN-2- YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID | A | 1FCX | 0.71 | |
PPT | 3-(P-TOLYL)PROPIONIC ACID | A,B | 2AY4 | 0.71 | |
OST | METHYL (2Z)-3-METHOXY-2-{2-[(E)- 2-PHENYLVINYL]PHENYL}ACRYLATE | C,D,E | 1SQQ | 0.71 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A,B,M,N | 1FJM | 0.73 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A | 1EVA | 0.73 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A | 1LCM | 0.73 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A,B,C,D,E,F, G,H | 2NYM | 0.73 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | C,I | 2IE3 | 0.73 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | C,F,X,Y | 2NPP | 0.73 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A | 1EVC | 0.73 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | C,F,G,H | 3DW8 | 0.73 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A,B,C,D,E,F, G,H | 2NYL | 0.73 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A | 1EVD | 0.73 | |
ADD | 2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID | A | 1EVB | 0.73 | |
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 | |
254 | 6-[HYDROXYIMINO-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTALEN-2- YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID | A | 1FD0 | 0.71 | |
5PV | 5-PHENYLVALERIC ACID | A,B | 2AY9 | 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 | |
MEA | N-METHYLPHENYLALANINE | A | 2PIL | 0.72 | |
MEA | N-METHYLPHENYLALANINE | A,B,C,D | 1H0I | 0.72 | |
MEA | N-METHYLPHENYLALANINE | A,B,I | 1DOJ | 0.72 | |
SBD | D-NAPHTHYL-1-ACETAMIDO BORONIC ACID ALANINE | A | 3VSB | 0.7 | |
864 | (2S)-2-[3-(AMINOMETHYL)PHENYL]- 3-[(R)-[(1R)-1-{[(BENZYLOXY)CARBONYL]AMINO}- 2-METHYLPROPYL](HYDROXY)PHOSPHORYL]PROPANOIC ACID | A,B,C | 2PJ2 | 0.7 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY5 | 0.71 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY8 | 0.71 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY9 | 0.71 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XXZ | 0.71 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY4 | 0.71 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY6 | 0.71 | |
LLG | 2-aminoethyl naphthalen-1-ylacetate | A | 3BC4 | 0.78 | |
NLA | NAPHTHALEN-1-YL-ACETIC ACID | A,B,C,D | 1LRH | 0.84 | |
NLA | NAPHTHALEN-1-YL-ACETIC ACID | B | 2P1O | 0.84 | |
BEY | (2S)-3-[(R)-[(1S)-1-amino-3-phenylpropyl](hydroxy)phosphoryl]- 2-benzylpropanoic acid | A | 3EBI | 0.74 | |
APD | 3-METHYLPHENYLALANINE | A,B,C | 1GMY | 0.73 | |
OX1 | H,Y | 1LO2 | 0.72 | ||
ALN | NAPHTHALEN-2-YL-3-ALANINE | A,B,I,J | 2FIV | 0.81 | |
ALN | NAPHTHALEN-2-YL-3-ALANINE | A,B | 1B0H | 0.81 | |
ALN | NAPHTHALEN-2-YL-3-ALANINE | B | 1FIV | 0.81 | |
ALN | NAPHTHALEN-2-YL-3-ALANINE | A,B,I,J | 3FIV | 0.81 | |
BZS | L-BENZYLSUCCINIC ACID | A | 1CBX | 0.7 | |
BZS | L-BENZYLSUCCINIC ACID | A | 1HYT | 0.7 | |
BZS | L-BENZYLSUCCINIC ACID | A,B | 1WHT | 0.7 | |
S1S | 2-(4-((9S,10S,14S,Z)-18-(2-AMINO- 2-OXOETHYL)-9-(CARBOXYMETHYL)-14- (NAPHTHALEN-1-YLMETHYL)-8,17,20- TRIOXO-7,16,19-TRIAZASPIRO[5.14]ICOS- 11-EN-10-YL)PHENYL)MALONIC ACID | A,B,C,D | 2AOB | 0.73 | |
S1S | 2-(4-((9S,10S,14S,Z)-18-(2-AMINO- 2-OXOETHYL)-9-(CARBOXYMETHYL)-14- (NAPHTHALEN-1-YLMETHYL)-8,17,20- TRIOXO-7,16,19-TRIAZASPIRO[5.14]ICOS- 11-EN-10-YL)PHENYL)MALONIC ACID | A,B | 2AOA | 0.73 | |
BNA | BIS-(NAPHTHYL-1-METHYL) ACETIC ACID | I | 4ER1 | 0.8 | |
BNA | BIS-(NAPHTHYL-1-METHYL) ACETIC ACID | A | 1FQ5 | 0.8 | |
NDD | 2,6-DICARBOXYNAPHTHALENE | A | 1U4O | 0.75 | |
NDD | 2,6-DICARBOXYNAPHTHALENE | A,B,C,D | 1HAC | 0.75 | |
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 | |
BJI | 1(R)-1-ACETAMIDO-2-(3-CARBOXYPHENYL)ETHYL BORONIC ACID | A | 1ERM | 0.7 | |
DAI | (3AS,9AS)-2-PENTYL-4-HYDROXYMETHYL- 3A,4,9,9A-TETRAHYDRO-4,9[1',2']- BENZENO-1H-BENZ[F]ISOINDOLE-1,3(2H)- DIONE | A,B,C,D | 1YLS | 0.74 | |
DAI | (3AS,9AS)-2-PENTYL-4-HYDROXYMETHYL- 3A,4,9,9A-TETRAHYDRO-4,9[1',2']- BENZENO-1H-BENZ[F]ISOINDOLE-1,3(2H)- DIONE | A,B,C,D | 1YKV | 0.74 | |
NPS | (2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid | A | 2VDB | 0.7 | |
CLT | 4-PHENYL-BUTANOIC ACID | A | 1THL | 0.71 | |
CLT | 4-PHENYL-BUTANOIC ACID | A,B | 2AY7 | 0.71 | |
CLT | 4-PHENYL-BUTANOIC ACID | E,I | 1TMN | 0.71 | |
BR4 | 6-PHENYL-4(R)-(7-PHENYL-HEPTANOYLAMINO)- HEXANOIC ACID | A | 1KQU | 0.77 | |
DFA | DIPHENYLACETIC ACID | A,B,C | 1GMY | 0.78 | |
SBL | L-NAPHTHYL-1-ACETAMIDO BORONIC ACID ALANINE | A | 1AV7 | 0.7 | |
IGL | ALPHA-AMINO-2-INDANACETIC ACID | A | 1BDK | 0.73 |