Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02362563
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 |
605 | 4'-[(1R)-1-amino-2-(2,5-difluorophenyl)ethyl]biphenyl- 3-carboxamide | A,B | 3D4L | 0.78 | |
GK5 | N~3~-cyclopropyl-N~4~'-(cyclopropylmethyl)- 6-methylbiphenyl-3,4'-dicarboxamide | A | 3D7Z | 0.72 | |
FPB | N-({(2S)-1-[(3R)-3-AMINO-4-(2-FLUOROPHENYL)BUTANOYL]PYRROLIDIN- 2-YL}METHYL)BENZAMIDE | A,B | 2BUB | 0.7 | |
HBC | (2-AMINO-3-PHENYL-BICYCLO[2.2.1]HEPT- 2-YL)-PHENYL-METHANONE | H | 1JGU | 0.77 | |
1LP | TRANYLCYPROMINE | A,B | 1OJB | 0.71 | |
SP8 | N-{(1S)-3-[(4-aminobutyl)amino]- 1-methylpropyl}benzamide | A,B | 3CNS | 0.72 | |
U1N | 4-[(3R)-3-{[2-(4-FLUOROPHENYL)- 2-OXOETHYL]AMINO}BUTYL]BENZAMIDE | A,B | 2OGZ | 0.74 | |
TRJ | META-DI(AMINOMETHYL)BENZENE | A,I | 1GVV | 0.72 | |
TRJ | META-DI(AMINOMETHYL)BENZENE | A | 1FQ5 | 0.72 | |
PG9 | D-PHENYLGLYCINE | A,B,G,H | 10GS | 0.72 | |
PG9 | D-PHENYLGLYCINE | A,B,C,D | 2B4K | 0.72 | |
IPO | PARA-IODO-D-PHENYLALANINE HYDROXAMIC ACID | A | 1IGB | 0.77 | |
N4T | (1S)-1-CYCLOPROPYL-2-[(2S)-4-(2,5- DIFLUOROPHENYL)-2-PHENYL-2,5-DIHYDRO- 1H-PYRROL-1-YL]-2-OXOETHANAMINE | A,B | 2FL2 | 0.71 | |
3AB | 3-aminobenzamide | A,B,C,D | 3GOY | 0.74 | |
PHA | PHENYLALANINAL | A,B | 1OB2 | 0.76 | |
PHA | PHENYLALANINAL | V,Y,Z | 2WDG | 0.76 | |
PHA | PHENYLALANINAL | V,Y,Z | 2WDK | 0.76 | |
PHA | PHENYLALANINAL | 1,2,4,5,A,B, C,D,E,J,K,L, M,N,O,P,R,S, T,U,V,Z | 1M90 | 0.76 | |
PHA | PHENYLALANINAL | P | 3SGA | 0.76 | |
PHA | PHENYLALANINAL | A,B,C,D,E,F | 1OB5 | 0.76 | |
PHA | PHENYLALANINAL | V,Y,Z | 2WDM | 0.76 | |
PHA | PHENYLALANINAL | 0,2,4,9,A,B, C,H,I,J,K,L, M,N,P,Q,R,S, T,X,Y,Z | 1KQS | 0.76 | |
PHA | PHENYLALANINAL | A,B | 1KDV | 0.76 | |
PHA | PHENYLALANINAL | 1,2,4,5,6,A, B,C,D,E,J,K, L,M,N,O,P,R, S,T,U,V,Z | 1Q86 | 0.76 | |
PHA | PHENYLALANINAL | A,B | 1KDY | 0.76 | |
PHA | PHENYLALANINAL | V,Y,Z | 3FIC | 0.76 | |
PHA | PHENYLALANINAL | V,Y,Z | 2WDH | 0.76 | |
PHA | PHENYLALANINAL | A,B | 1KE2 | 0.76 | |
HY1 | PHENYLACETALDEHYDE | D,H | 2I0S | 0.7 | |
HY1 | PHENYLACETALDEHYDE | A,B | 1D6Y | 0.7 | |
HY1 | PHENYLACETALDEHYDE | A,B | 1D6Z | 0.7 | |
HY1 | PHENYLACETALDEHYDE | D,H | 2OK4 | 0.7 | |
HY1 | PHENYLACETALDEHYDE | A,B | 1D6U | 0.7 | |
HPQ | HOMOPHENYLALANINYLMETHANE | B | 1EWP | 0.77 | |
BIF | (R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID | G,M,P,S | 1YYL | 0.73 | |
BIF | (R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID | G,M,P,S | 2I5Y | 0.73 | |
BBA | 2,7-BIS-(4-AMIDINOBENZYLIDENE)- CYCLOHEPTAN-1-ONE | A,B | 1A5H | 0.75 | |
BBA | 2,7-BIS-(4-AMIDINOBENZYLIDENE)- CYCLOHEPTAN-1-ONE | T | 1V2N | 0.75 | |
53U | D-phenylalanyl-N-benzyl-L-prolinamide | H,I | 2ZFF | 0.75 | |
BVA | TRIHYDROXY[(N-HYDROXYBENZAMIDATO)OXO]VANADATE | B,C | 2P8O | 0.74 | |
B2Y | 1-biphenyl-2-ylmethanamine | A,B,C,D | 3CCB | 0.77 | |
S27 | N-[[2-METHYL-4-HYDROXYCARBAMOYL]BUT- 4-YL-N]-BENZYL-P-[PHENYL]-P-[METHYL]PHOSPHINAMID | A,B | 1B3D | 0.71 | |
PCS | PHENYLALANYLMETHYLCHLORIDE | B,D | 1DLK | 0.71 | |
PCS | PHENYLALANYLMETHYLCHLORIDE | A | 1XQX | 0.71 | |
008 | (S)-2-[(R)-3-AMINO-4-(2-FLUORO- PHENYL)-BUTYRYL]-1,2,3,4-TETRAHYDRO- ISOQUINOLINE-3-CARBOXYLIC ACID AMIDE | A,B,C,D | 2BUC | 0.72 | |
51U | D-phenylalanyl-N-(3-methylbenzyl)- L-prolinamide | H,I | 2ZF0 | 0.75 | |
PSS | ETHYLAMINOBENZYLMETHYLCARBONYL GROUP | A | 1EAG | 0.71 | |
44U | beta-phenyl-D-phenylalanyl-N-propyl- L-prolinamide | B,D | 3DA9 | 0.74 | |
4PI | N-(4-METHYLBENZOYL)-4-BENZYLPIPERIDINE | A,B | 2NSD | 0.72 | |
PZQ | PRAZIQUANTEL | A | 1GTB | 0.71 | |
37U | D-phenylalanyl-N-(3-fluorobenzyl)- L-prolinamide | H,I | 2ZDV | 0.73 | |
NAM | NAM NAPTHYLAMINOALANINE | A,B,I,J | 3FIV | 0.84 | |
NAM | NAM NAPTHYLAMINOALANINE | A,B,I,J | 2FIV | 0.84 | |
DHQ | 3,4-DIHYDRO-5-METHYL-ISOQUINOLINONE | A | 1PAX | 0.71 | |
BP4 | BIPHENYL-4-YL-ACETALDEHYDE | A,B,E,F,G,H | 1MHW | 0.75 | |
BZQ | DIPHENYLMETHANONE | A,B | 1GT5 | 0.72 | |
BZQ | DIPHENYLMETHANONE | A,B | 1DZP | 0.72 | |
BHO | BENZHYDROXAMIC ACID | A,B | 1GX2 | 0.76 | |
BHO | BENZHYDROXAMIC ACID | A | 1HSR | 0.76 | |
BHO | BENZHYDROXAMIC ACID | A,B | 2ATJ | 0.76 | |
BHO | BENZHYDROXAMIC ACID | A,B | 4ATJ | 0.76 | |
BHO | BENZHYDROXAMIC ACID | A,B | 3ATJ | 0.76 | |
BHO | BENZHYDROXAMIC ACID | A | 3GCK | 0.76 | |
BHO | BENZHYDROXAMIC ACID | A,B,C,D,E,F, G,H | 2BOY | 0.76 | |
NFA | PHENYLALANINE AMIDE | A,B,C,D | 2BTJ | 0.84 | |
NFA | PHENYLALANINE AMIDE | A,B,C,D,E,F | 2EFX | 0.84 | |
NFA | PHENYLALANINE AMIDE | A,B,C,D | 2VVJ | 0.84 | |
NFA | PHENYLALANINE AMIDE | A | 2A4O | 0.84 | |
NFA | PHENYLALANINE AMIDE | A,B | 1XAE | 0.84 | |
NFA | PHENYLALANINE AMIDE | A,B,C,D | 2OGR | 0.84 | |
NFA | PHENYLALANINE AMIDE | A,B,C,D | 1QA7 | 0.84 | |
NFA | PHENYLALANINE AMIDE | A,B,C,D | 2GW4 | 0.84 | |
SP9 | N-{(1R)-3-[(4-aminobutyl)amino]- 1-methylpropyl}benzamide | A,B | 3CNT | 0.72 | |
JNH | 1-[2-(S)-AMINO-3-BIPHENYL-4-YL- PROPIONYL]-PYRROLIDINE-2-(S)-CARBONITRILE | I,J | 2AJL | 0.77 | |
PHM | PHENYLALANYLMETHANE | A,I | 1PJP | 0.77 | |
PHM | PHENYLALANYLMETHANE | A,B,C | 2J9J | 0.77 | |
PHM | PHENYLALANYLMETHANE | A,B,C | 2JE4 | 0.77 |