Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02823681
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 |
DNS | N~6~-{[5-(DIMETHYLAMINO)-1-NAPHTHYL]SULFONYL}- L-LYSINE | H | 1WZ1 | 0.72 | |
MX5 | {1-[4-(3,4-DIHYDROQUINOLIN-1(2H)- YL)-4-OXOBUTANOYL]HYDRAZINO}ACETIC ACID | B,I | 2C2Z | 0.71 | |
EBW | 4-(5-{4-[DIMETHYL(PROP-2-ENYL)AMMONIO]PHENYL}- 3-OXOPENTYL)-N,N-DIMETHYL-N-PROP- 2-ENYLBENZENAMINIUM | A | 1E3Q | 0.75 | |
4DP | 3-[5-(DIMETHYLAMINO)-1,3-DIOXO- 1,3-DIHYDRO-2H-ISOINDOL-2-YL]-L- ALANINE | C | 2IPK | 0.71 | |
BC1 | 3-{[(9-CYANO-9,10-DIHYDRO-10-METHYLACRIDIN- 9-YL)CARBONYL]AMINO}PROPANOIC ACID | H,Y | 1LO0 | 0.71 | |
2UN | {4-[2-BENZYL-3-METHOXY-2-(METHOXYCARBONYL)- 3-OXOPROPYL]PHENYL}SULFAMIC ACID | A,B | 2H02 | 0.7 | |
GF7 | (3S)-1-(4-acetylphenyl)-5-oxopyrrolidine- 3-carboxylic acid | A | 3GQZ | 0.7 | |
ZAB | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3S | 0.73 | |
ZAB | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B,C,D | 2H4B | 0.73 | |
C47 | METHYL (3R)-1-[(5S,6S,8R)-5-AMINO- 9-BUTYLAMINO-6-HYDROXY-3,3,8-TRIMETHYL- 9-OXO-NONANOYL]-3,4-DIHYDRO-2H- QUINOLINE-3-CARBOXYLATE | C,O | 2V16 | 0.71 | |
G1L | 3-CHLORO-2,2-DIMETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE | A,B | 2I80 | 0.7 | |
FEX | A | 1OSH | 0.74 | ||
4PH | 4-methyl-L-phenylalanine | B,C | 3BV9 | 0.72 | |
EAB | (3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3T | 0.73 | |
ZAE | N-methyl-D-phenylalanine | H,I,R | 1TBZ | 0.72 | |
LZ6 | L-gamma-glutamyl-S-(2-{[4-(3-carboxypropyl)phenyl](2- chloroethyl)amino}ethyl)-L-cysteinylglycine | A,B,C,D | 3CSI | 0.77 | |
LZ6 | L-gamma-glutamyl-S-(2-{[4-(3-carboxypropyl)phenyl](2- chloroethyl)amino}ethyl)-L-cysteinylglycine | A,B | 3CSH | 0.77 | |
AAH | H | 1KEL | 0.71 | ||
AAH | B,H | 1FL6 | 0.71 | ||
SPB | 4-(4-STYRYL-PHENYLCARBAMOYL)-BUTYRIC ACID | B,H | 1UB5 | 0.74 | |
SPB | 4-(4-STYRYL-PHENYLCARBAMOYL)-BUTYRIC ACID | A,B,H,L | 3CFB | 0.74 | |
SPB | 4-(4-STYRYL-PHENYLCARBAMOYL)-BUTYRIC ACID | B,H | 3CFD | 0.74 | |
SPB | 4-(4-STYRYL-PHENYLCARBAMOYL)-BUTYRIC ACID | A,L | 1FL3 | 0.74 | |
CBL | CHLORAMBUCIL | A,B | 3CSJ | 0.92 | |
MPQ | N-METHYL-ALPHA-PHENYL-GLYCINE | D | 1D6E | 0.73 | |
EOT | [(1-[(BIS-CARBOXYMETHYL-AMINO)- METHYL]-2-{4-[3-(2-HYDROXY-ETHYL)- THIOUREIDO]-PHENY}-ETHYL)-CARBOXYMETHYL- AMINO]-ACETIC ACID | H | 1INE | 0.7 | |
EOT | [(1-[(BIS-CARBOXYMETHYL-AMINO)- METHYL]-2-{4-[3-(2-HYDROXY-ETHYL)- THIOUREIDO]-PHENY}-ETHYL)-CARBOXYMETHYL- AMINO]-ACETIC ACID | H | 1IND | 0.7 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | B,C | 2BNI | 0.72 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | A | 1W5K | 0.72 | |
TYZ | PARA ACETAMIDO BENZOIC ACID | A | 1W5J | 0.72 | |
I84 | [2,6-DIMETHYL-4-(2-O-TOLYL-ACETYLAMINO)- BENZENESULFONYL]-GLYCINE | A | 1EKO | 0.71 | |
I84 | [2,6-DIMETHYL-4-(2-O-TOLYL-ACETYLAMINO)- BENZENESULFONYL]-GLYCINE | A | 1EL3 | 0.71 | |
PRQ | (3S)-3-amino-3-(2-nitrophenyl)propanoic acid | C,F,I,L | 2VE6 | 0.7 | |
LO1 | [[4-(AMINOMETHYL)PHENYL]AMINO]OXO- ACETIC ACID, | A | 1WAX | 0.75 | |
PG9 | D-PHENYLGLYCINE | A,B,G,H | 10GS | 0.71 | |
PG9 | D-PHENYLGLYCINE | A,B,C,D | 2B4K | 0.71 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY5 | 0.79 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY8 | 0.79 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY9 | 0.79 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XXZ | 0.79 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY4 | 0.79 | |
IAM | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY6 | 0.79 | |
XP1 | 4-(DIMETHYLAMINO)BENZOIC ACID | A,B | 2VJ1 | 0.74 | |
XP1 | 4-(DIMETHYLAMINO)BENZOIC ACID | A | 2V6N | 0.74 | |
KY1 | 4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID | A,B,C,D | 2CH2 | 0.7 | |
ST6 | 4-(ACETYLAMINO)-3-[(AMINOACETYL)AMINO]BENZOIC ACID | A,B | 1INH | 0.71 | |
3B4 | 2-(cyclohexylamino)benzoic acid | A,B | 3B4P | 0.73 | |
LZQ | 4-[3-(dibenzylamino)phenyl]-2,4- dioxobutanoic acid | A | 3EB1 | 0.72 | |
DIF | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A,B | 3CFQ | 0.77 | |
DIF | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A | 1SV9 | 0.77 | |
DIF | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A | 1NR6 | 0.77 | |
DIF | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A | 3HWV | 0.77 | |
DIF | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | B | 1DVX | 0.77 | |
DIF | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A | 2B6D | 0.77 | |
DIF | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A,B,C,D | 1PXX | 0.77 | |
DIF | 2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID | A | 2B17 | 0.77 | |
LIZ | N-{(1S,2S)-2-[bis(carboxymethyl)amino]cyclohexyl}- N-{(2R)-2-[bis(carboxymethyl)amino]- 3-[4-({[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]carbamothioyl}amino)phenyl]propyl}glycine | A,B | 3DSZ | 0.7 | |
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 | |
APD | 3-METHYLPHENYLALANINE | A,B,C | 1GMY | 0.72 | |
FRF | PHE-REDUCED-PHE | A,I | 1GVX | 0.71 | |
HAQ | 5-AMINO-4-OXO-1,2,4,5,6,7-HEXAHYDRO- AZEPINO[3,2,1-HI]INDOLE-2-CARBOXYLIC ACID | D | 1D5X | 0.72 | |
NOX | N-(PARA-GLUTARAMIDOPHENYL-ETHYL)- PIPERIDINIUM-N-OXIDE | L | 35C8 | 0.76 | |
VG0 | N-{(1S,2R)-1-benzyl-2-hydroxy-3- [(1,1,5-trimethylhexyl)amino]propyl}- 3-(ethylamino)-5-(2-oxopyrrolidin- 1-yl)benzamide | A | 2VIE | 0.7 | |
INH | N-(R-CARBOXY-ETHYL)-ALPHA-(S)-(2- PHENYLETHYL)GLYCYL-L-ARGININE-N- PHENYLAMIDE | A | 1SLN | 0.72 | |
INH | N-(R-CARBOXY-ETHYL)-ALPHA-(S)-(2- PHENYLETHYL)GLYCYL-L-ARGININE-N- PHENYLAMIDE | A | 2SRT | 0.72 | |
INH | N-(R-CARBOXY-ETHYL)-ALPHA-(S)-(2- PHENYLETHYL)GLYCYL-L-ARGININE-N- PHENYLAMIDE | A | 3BG8 | 0.72 | |
DPN | D-PHENYLALANINE | P | 1MCS | 0.71 | |
DPN | D-PHENYLALANINE | A | 1GOE | 0.71 | |
DPN | D-PHENYLALANINE | A | 2RM9 | 0.71 | |
DPN | D-PHENYLALANINE | A | 1SOC | 0.71 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1SFQ | 0.71 | |
DPN | D-PHENYLALANINE | I | 1ABJ | 0.71 | |
DPN | D-PHENYLALANINE | P | 1DWE | 0.71 | |
DPN | D-PHENYLALANINE | I,M | 1HLT | 0.71 | |
DPN | D-PHENYLALANINE | A,H,L | 1J9C | 0.71 | |
DPN | D-PHENYLALANINE | I,T | 1TMB | 0.71 | |
DPN | D-PHENYLALANINE | A | 2JRY | 0.71 | |
DPN | D-PHENYLALANINE | A | 2SOC | 0.71 | |
DPN | D-PHENYLALANINE | A | 2YYF | 0.71 | |
DPN | D-PHENYLALANINE | I | 2HGT | 0.71 | |
DPN | D-PHENYLALANINE | A,D | 2Q3I | 0.71 | |
DPN | D-PHENYLALANINE | A,P | 1MCD | 0.71 | |
DPN | D-PHENYLALANINE | P | 1HAO | 0.71 | |
DPN | D-PHENYLALANINE | A,B,I | 1Z8J | 0.71 | |
DPN | D-PHENYLALANINE | A,B,C | 2PGQ | 0.71 | |
DPN | D-PHENYLALANINE | C,D,H,I,L,M, X,Y | 1DVA | 0.71 | |
DPN | D-PHENYLALANINE | P | 1NRR | 0.71 | |
DPN | D-PHENYLALANINE | I | 1PPB | 0.71 | |
DPN | D-PHENYLALANINE | C,D,G,H | 1NU7 | 0.71 | |
DPN | D-PHENYLALANINE | I | 2HPP | 0.71 | |
DPN | D-PHENYLALANINE | B,C | 2OD3 | 0.71 | |
DPN | D-PHENYLALANINE | A | 1B0Q | 0.71 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1NU9 | 0.71 | |
DPN | D-PHENYLALANINE | A,B,I | 1Z8I | 0.71 | |
DPN | D-PHENYLALANINE | H,I,J | 1TMU | 0.71 | |
DPN | D-PHENYLALANINE | A,B,C,D,E,F | 2DNS | 0.71 | |
DPN | D-PHENYLALANINE | A | 1GO9 | 0.71 | |
DPN | D-PHENYLALANINE | B,C,E,F | 1A0H | 0.71 | |
DPN | D-PHENYLALANINE | P | 1MCF | 0.71 | |
DPN | D-PHENYLALANINE | A | 2RME | 0.71 | |
DPN | D-PHENYLALANINE | H,I | 1TMT | 0.71 | |
DPN | D-PHENYLALANINE | I | 1ABI | 0.71 | |
DPN | D-PHENYLALANINE | R | 1NRQ | 0.71 | |
DPN | D-PHENYLALANINE | B,C,F,G | 2A1D | 0.71 | |
DPN | D-PHENYLALANINE | A,B | 2Q33 | 0.71 | |
DPN | D-PHENYLALANINE | C,H,L | 1DAN | 0.71 | |
DPN | D-PHENYLALANINE | P | 1MCE | 0.71 | |
DPN | D-PHENYLALANINE | B,C,E,F | 2A45 | 0.71 | |
DPN | D-PHENYLALANINE | A | 2RMI | 0.71 | |
DPN | D-PHENYLALANINE | A,B,I | 1TQ7 | 0.71 | |
DPN | D-PHENYLALANINE | A | 1W7M | 0.71 | |
DPN | D-PHENYLALANINE | P | 1HAP | 0.71 | |
DPN | D-PHENYLALANINE | A,B | 1ORF | 0.71 | |
DPN | D-PHENYLALANINE | I | 1IHS | 0.71 | |
DPN | D-PHENYLALANINE | P | 1MCC | 0.71 | |
DPN | D-PHENYLALANINE | A | 2RMD | 0.71 | |
DPN | D-PHENYLALANINE | A | 2JQB | 0.71 | |
DPN | D-PHENYLALANINE | I | 2HPQ | 0.71 | |
DPN | D-PHENYLALANINE | C,E,F | 1SHH | 0.71 | |
DPN | D-PHENYLALANINE | A,I | 1CVR | 0.71 | |
DPN | D-PHENYLALANINE | L,P | 1AUT | 0.71 | |
DPN | D-PHENYLALANINE | P | 1MCI | 0.71 | |
DPN | D-PHENYLALANINE | H,I | 3F6U | 0.71 | |
DPN | D-PHENYLALANINE | A | 1BFW | 0.71 | |
DPN | D-PHENYLALANINE | H,I | 1HAI | 0.71 | |
DPN | D-PHENYLALANINE | B,C | 2THF | 0.71 | |
DPN | D-PHENYLALANINE | I | 1IHT | 0.71 | |
DPN | D-PHENYLALANINE | A,P | 1MCJ | 0.71 | |
DPN | D-PHENYLALANINE | A | 1TKH | 0.71 | |
DPN | D-PHENYLALANINE | C,H,L,T | 2FIR | 0.71 | |
DPN | D-PHENYLALANINE | A | 2FMZ | 0.71 | |
DPN | D-PHENYLALANINE | A | 1YL9 | 0.71 | |
DPN | D-PHENYLALANINE | I | 1HUT | 0.71 | |
DPN | D-PHENYLALANINE | I | 1FXY | 0.71 | |
DPN | D-PHENYLALANINE | A | 1YL8 | 0.71 | |
DPN | D-PHENYLALANINE | C,H,L | 1QFK | 0.71 | |
DPN | D-PHENYLALANINE | P | 1MCB | 0.71 | |
PNC | PARA-NITROBENZYL GLUTARYL GLYCINIC ACID | L | 1YEF | 0.71 | |
PPN | PARA-NITROPHENYLALANINE | I | 1YTJ | 0.77 | |
GEP | N-METHYL-N-(PARA-GLUTARAMIDOPHENYL- ETHYL)-PIPERIDINIUM ION | L | 25C8 | 0.79 | |
TSN | TRICHOSTATIN A | A,B | 1T64 | 0.72 | |
TSN | TRICHOSTATIN A | A,B | 1C3R | 0.72 | |
TSN | TRICHOSTATIN A | A,B,C | 3F0R | 0.72 | |
TSN | TRICHOSTATIN A | A,B,C | 3C10 | 0.72 | |
B3N | 4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE- N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE | A,B | 3F06 | 0.75 | |
B3N | 4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE- N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE | A,B | 3EZP | 0.75 | |
B3N | 4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE- N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE | A | 3EW8 | 0.75 | |
B3N | 4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE- N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE | A,B | 3EZT | 0.75 | |
B3N | 4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE- N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE | A | 1T67 | 0.75 | |
TNS | A,B,L | 2G2R | 0.75 | ||
KYN | KYNURENINE | A,B,C,D | 2R2N | 0.73 | |
KYN | KYNURENINE | A,B | 3E2Z | 0.73 | |
KYN | KYNURENINE | A | 1XT7 | 0.73 | |
KYN | KYNURENINE | A | 1T5M | 0.73 | |
KYN | KYNURENINE | A | 1T5N | 0.73 | |
KYN | KYNURENINE | A | 2VOV | 0.73 | |
KYN | KYNURENINE | A | 2VOX | 0.73 | |
AHC | 4-AMINOHYDROCINNAMIC ACID | A,B | 2AY1 | 0.8 | |
MRE | 2-(4-DIMETHYLAMINOPHENYL)DIAZENYLBENZOIC ACID | A,B | 2V9C | 0.71 | |
W22 | [(2S)-4-methyl-3-oxo-2,3,4,5-tetrahydro- 1H-1,4-benzodiazepin-2-yl]acetic acid | A,B | 2WKW | 0.72 | |
CLK | ALPHA-N-DICHLOROACETYL-P-AMINOPHENYLSERINOL | A | 1GRQ | 0.71 |