Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02617257
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 |
GNB![]() | S-P-NITROBENZYLOXYCARBONYLGLUTATHIONE | A,B,C,D | 1QIP | 0.72 | ![]() |
PRQ![]() | (3S)-3-amino-3-(2-nitrophenyl)propanoic acid | C,F,I,L | 2VE6 | 0.84 | ![]() |
INH![]() | N-(R-CARBOXY-ETHYL)-ALPHA-(S)-(2- PHENYLETHYL)GLYCYL-L-ARGININE-N- PHENYLAMIDE | A | 1SLN | 0.71 | ![]() |
INH![]() | N-(R-CARBOXY-ETHYL)-ALPHA-(S)-(2- PHENYLETHYL)GLYCYL-L-ARGININE-N- PHENYLAMIDE | A | 2SRT | 0.71 | ![]() |
INH![]() | N-(R-CARBOXY-ETHYL)-ALPHA-(S)-(2- PHENYLETHYL)GLYCYL-L-ARGININE-N- PHENYLAMIDE | A | 3BG8 | 0.71 | ![]() |
B3N![]() | 4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE- N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE | A,B | 3F06 | 0.71 | ![]() |
B3N![]() | 4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE- N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE | A,B | 3EZP | 0.71 | ![]() |
B3N![]() | 4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE- N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE | A | 3EW8 | 0.71 | ![]() |
B3N![]() | 4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE- N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE | A,B | 3EZT | 0.71 | ![]() |
B3N![]() | 4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE- N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE | A | 1T67 | 0.71 | ![]() |
EAB![]() | (3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3T | 0.74 | ![]() |
APD![]() | 3-METHYLPHENYLALANINE | A,B,C | 1GMY | 0.71 | ![]() |
BNN![]() | ACETYL-P-AMIDINOPHENYLALANINE | 2,3,4 | 8KME | 0.72 | ![]() |
BNN![]() | ACETYL-P-AMIDINOPHENYLALANINE | H,I,J | 7KME | 0.72 | ![]() |
GEP![]() | N-METHYL-N-(PARA-GLUTARAMIDOPHENYL- ETHYL)-PIPERIDINIUM ION | L | 25C8 | 0.72 | ![]() |
NPC![]() | 4-HYDROXY-3-NITROPHENYLACETYL-EPSILON- AMINOCAPROIC ACID ANION | H,I,J | 1A6V | 0.74 | ![]() |
NIP![]() | 4-HYDROXY-5-IODO-3-NITROPHENYLACETYL- EPSILON-AMINOCAPROIC ACID ANION | H | 1A6W | 0.72 | ![]() |
TI3![]() | [(2S)-2-SULFANYL-3-PHENYLPROPANOYL]- GLY-(5-PHENYLPROLINE) | A | 1QF2 | 0.72 | ![]() |
ZAE![]() | N-methyl-D-phenylalanine | H,I,R | 1TBZ | 0.75 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 2ADP | 0.75 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 3DIV | 0.75 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 2H5U | 0.75 | ![]() |
NIY![]() | META-NITRO-TYROSINE | A | 1K4Q | 0.75 | ![]() |
NIY![]() | META-NITRO-TYROSINE | B,G,O,Y | 1SDA | 0.75 | ![]() |
ZAB![]() | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3S | 0.74 | ![]() |
ZAB![]() | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B,C,D | 2H4B | 0.74 | ![]() |
53N![]() | 3-[5-(3-nitrophenyl)thiophen-2- yl]propanoic acid | A | 3DN5 | 0.72 | ![]() |
BRX![]() | BROMAMPHENICOL | A,B,C,D,E,F | 2JKL | 0.74 | ![]() |
M09![]() | (3S,5R,7R,8S,9S,10R)-7-(hydroxymethyl)- 3-(4-nitrophenyl)-1,6-dioxa-2-azaspiro[4.5]decane- 8,9,10-triol | A | 2QRM | 0.71 | ![]() |
CL8![]() | CHLORAMPHENICOL SUCCINATE | A,B,C,D,E,F | 2JKN | 0.72 | ![]() |
PNC![]() | PARA-NITROBENZYL GLUTARYL GLYCINIC ACID | L | 1YEF | 0.84 | ![]() |
PIR![]() | 2-(4-AMINO-PHENYL)-5-HYDROXYMETHYL- PYRROLIDINE-3,4-DIOL | A,B,C,D | 2MAS | 0.73 | ![]() |
ING![]() | D-[(AMINO)CARBONYL]PHENYLALANINE | A,B | 1UF8 | 0.73 | ![]() |
ING![]() | D-[(AMINO)CARBONYL]PHENYLALANINE | A,B,D,E | 1HDU | 0.73 | ![]() |
INF![]() | D-[(N-HYDROXYAMINO)CARBONYL]PHENYLALANINE | A | 1HDQ | 0.75 | ![]() |
CLC![]() | N-ACETYL-P-NITROPHENYLSERINOL | A | 1GRR | 0.76 | ![]() |
MPQ![]() | N-METHYL-ALPHA-PHENYL-GLYCINE | D | 1D6E | 0.74 | ![]() |
CLM![]() | CHLORAMPHENICOL | A | 1K01 | 0.72 | ![]() |
CLM![]() | CHLORAMPHENICOL | 1,2,4,A,B,C, D,E,J,K,L,M, N,O,P,R,S,T, U,V,Z | 1NJI | 0.72 | ![]() |
CLM![]() | CHLORAMPHENICOL | A,B,C,D,E,F | 2JKL | 0.72 | ![]() |
CLM![]() | CHLORAMPHENICOL | A | 2XAT | 0.72 | ![]() |
CLM![]() | CHLORAMPHENICOL | A | 4CLA | 0.72 | ![]() |
CLM![]() | CHLORAMPHENICOL | A | 1CLA | 0.72 | ![]() |
CLM![]() | CHLORAMPHENICOL | A,B,C,D,E,F | 1USQ | 0.72 | ![]() |
CLM![]() | CHLORAMPHENICOL | A,B,C,D,E,F | 2JKJ | 0.72 | ![]() |
CLM![]() | CHLORAMPHENICOL | A,B | 2UXP | 0.72 | ![]() |
CLM![]() | CHLORAMPHENICOL | A | 1QHS | 0.72 | ![]() |
CLM![]() | CHLORAMPHENICOL | A | 1QHY | 0.72 | ![]() |
CLM![]() | CHLORAMPHENICOL | A | 3CLA | 0.72 | ![]() |
BAN![]() | HONH-BENZYLMALONYL-L-ALANYLGLYCINE- P-NITROANILIDE | A | 5TLN | 0.74 | ![]() |
PNB![]() | 4-NITRO-BENZYLPHOSPHONOBUTANOYL- GLYCINE | A,L | 1YED | 0.77 | ![]() |
PNB![]() | 4-NITRO-BENZYLPHOSPHONOBUTANOYL- GLYCINE | H,L | 1YEC | 0.77 | ![]() |
PNB![]() | 4-NITRO-BENZYLPHOSPHONOBUTANOYL- GLYCINE | H | 1YEE | 0.77 | ![]() |
HNT![]() | [(3R)-7-NITRO-1,2,3,4-TETRAHYDROISOQUINOLIN- 3-YL]METHANOL | A,B | 2G70 | 0.76 | ![]() |
1PA![]() | PHENYLMETHYLACETIC ACID ALANINE | I | 1BHF | 0.7 | ![]() |
NOX![]() | N-(PARA-GLUTARAMIDOPHENYL-ETHYL)- PIPERIDINIUM-N-OXIDE | L | 35C8 | 0.75 | ![]() |
FRF![]() | PHE-REDUCED-PHE | A,I | 1GVX | 0.73 | ![]() |
PG9![]() | D-PHENYLGLYCINE | A,B,G,H | 10GS | 0.71 | ![]() |
PG9![]() | D-PHENYLGLYCINE | A,B,C,D | 2B4K | 0.71 | ![]() |
RA4![]() | N-(4-NITROBENZOYL)-L-LEUCYL-N-(4- {[AMINO(IMINO)METHYL]AMINO}BUTYL)- L-PROLINAMIDE | H,I | 1YPM | 0.72 | ![]() |
LHY![]() | L-[(N-HYDROXYAMINO)CARBONYL]PHENYLALANINE | A,B,D,E | 1HEE | 0.75 | ![]() |
4PH![]() | 4-methyl-L-phenylalanine | B,C | 3BV9 | 0.71 | ![]() |
MNP![]() | 2-(3-NITROPHENYL)ACETIC ACID | B | 1AI5 | 0.77 | ![]() |
002![]() | N-[(2R)-2-BENZYL-4-(HYDROXYAMINO)- 4-OXOBUTANOYL]-L-ISOLEUCYL-L-LEUCINE | A,B | 2FV9 | 0.73 | ![]() |
CBL![]() | CHLORAMBUCIL | A,B | 3CSJ | 0.71 | ![]() |
IAM![]() | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY5 | 0.76 | ![]() |
IAM![]() | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY8 | 0.76 | ![]() |
IAM![]() | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY9 | 0.76 | ![]() |
IAM![]() | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XXZ | 0.76 | ![]() |
IAM![]() | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY4 | 0.76 | ![]() |
IAM![]() | 4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE | A | 1XY6 | 0.76 | ![]() |
KEL![]() | N-[(2R)-2-benzyl-4-(hydroxyamino)- 4-oxobutanoyl]-L-alanine | X | 3B7U | 0.73 | ![]() |
DOF![]() | (S)-2-(4-NITROBENZYL)-1,4,7,10- TETRAAZACYCLODODECANE-N,N',N'',N'''- TETRAACETATE | A,B,C,D | 1NC4 | 0.78 | ![]() |
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 | ![]() |
AHC![]() | 4-AMINOHYDROCINNAMIC ACID | A,B | 2AY1 | 0.76 | ![]() |
23N![]() | (2R)-2-benzyl-3-nitropropanoic acid | A | 2RFH | 0.71 | ![]() |
TNS![]() | A,B,L | 2G2R | 0.77 | ![]() | |
AAH![]() | H | 1KEL | 0.78 | ![]() | |
AAH![]() | B,H | 1FL6 | 0.78 | ![]() | |
NDF![]() | N-(CARBOXYCARBONYL)-D-PHENYLALANINE | A | 1YCI | 0.74 | ![]() |
CXA![]() | PHENYLALANINE-N-SULFONAMIDE | A | 1IY7 | 0.71 | ![]() |
NPG![]() | N-SUCCINYL PHENYLGLYCINE | A,B,C,D | 1SJD | 0.73 | ![]() |
PPN![]() | PARA-NITROPHENYLALANINE | I | 1YTJ | 0.89 | ![]() |
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 | ![]() |
AAN![]() | 2-(4-NITROPHENYL)ACETIC ACID | B | 1AJN | 0.78 | ![]() |
MEA![]() | N-METHYLPHENYLALANINE | A | 2PIL | 0.75 | ![]() |
MEA![]() | N-METHYLPHENYLALANINE | A,B,C,D | 1H0I | 0.75 | ![]() |
MEA![]() | N-METHYLPHENYLALANINE | A,B,I | 1DOJ | 0.75 | ![]() |
GTB![]() | S-(P-NITROBENZYL)GLUTATHIONE | A,B | 2OAD | 0.78 | ![]() |
GTB![]() | S-(P-NITROBENZYL)GLUTATHIONE | A,B,C,D,E,F | 1GTI | 0.78 | ![]() |
GTB![]() | S-(P-NITROBENZYL)GLUTATHIONE | A,B | 2OAC | 0.78 | ![]() |
GTB![]() | S-(P-NITROBENZYL)GLUTATHIONE | A,B | 1GLQ | 0.78 | ![]() |
GTB![]() | S-(P-NITROBENZYL)GLUTATHIONE | B,D | 2QMC | 0.78 | ![]() |
GTB![]() | S-(P-NITROBENZYL)GLUTATHIONE | A,B | 2VO4 | 0.78 | ![]() |
GTB![]() | S-(P-NITROBENZYL)GLUTATHIONE | A,B,C,D | 1K0C | 0.78 | ![]() |
4NB![]() | 4-NITROBENZOIC ACID | A,B | 3CHT | 0.72 | ![]() |
HAQ![]() | 5-AMINO-4-OXO-1,2,4,5,6,7-HEXAHYDRO- AZEPINO[3,2,1-HI]INDOLE-2-CARBOXYLIC ACID | D | 1D5X | 0.74 | ![]() |
885![]() | 1-[(2-AMINO-4-CHLORO-5-METHYLPHENYL)SULFONYL]- L-PROLINE | A,B | 2GC8 | 0.7 | ![]() |
LO1![]() | [[4-(AMINOMETHYL)PHENYL]AMINO]OXO- ACETIC ACID, | A | 1WAX | 0.72 | ![]() |
LPR![]() | [N2-[(S)-1-CARBOXY-3-PHENYLPROPYL]- L-LYSYL-L-PROLINE | A,B | 1J36 | 0.75 | ![]() |
LPR![]() | [N2-[(S)-1-CARBOXY-3-PHENYLPROPYL]- L-LYSYL-L-PROLINE | A,B | 2C6N | 0.75 | ![]() |
LPR![]() | [N2-[(S)-1-CARBOXY-3-PHENYLPROPYL]- L-LYSYL-L-PROLINE | A | 1O86 | 0.75 | ![]() |
EAL![]() | 1-((2S)-2-{[(1S)-1-CARBOXY-3-PHENYLPROPYL]AMINO}PROPANOYL)- L-PROLINE | A | 1UZE | 0.74 | ![]() |