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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00483038

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
FOE2-(2-AMINO-3-OXO-PROPYLSULFANYL)-
N-(4-FLUORO-PHENYL)-N-ISOPROPYL-
ACETAMIDE
B1BX90.72
CS1S-(2-ANILINYL-SULFANYL)-CYSTEINEA,B2OMA0.84
GTBS-(P-NITROBENZYL)GLUTATHIONEA,B2OAD0.71
GTBS-(P-NITROBENZYL)GLUTATHIONEA,B,C,D,E,F1GTI0.71
GTBS-(P-NITROBENZYL)GLUTATHIONEA,B2OAC0.71
GTBS-(P-NITROBENZYL)GLUTATHIONEA,B1GLQ0.71
GTBS-(P-NITROBENZYL)GLUTATHIONEB,D2QMC0.71
GTBS-(P-NITROBENZYL)GLUTATHIONEA,B2VO40.71
GTBS-(P-NITROBENZYL)GLUTATHIONEA,B,C,D1K0C0.71
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A,B5GST0.76
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A1HNA0.76
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A,B1VF30.76
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A,B,C,D1HNC0.76
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A,B,C1XWK0.76
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A,B18GS0.76
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A1GSQ0.76
GDNGLUTATHIONE S-(2,4 DINITROBENZENE)A,B1HNB0.76
PRQ(3S)-3-amino-3-(2-nitrophenyl)propanoic acidC,F,I,L2VE60.7
TYXS-(2-ANILINO-2-OXOETHYL)-L-CYSTEINEA2PQT0.75
AAS3-ACTOXYMERCURI-4-AMINOBENZENESULFONAMIDEA1CZM0.73
TNBS-(2,3,6-TRINITROPHENYL)CYSTEINEA,B,C,D,E,F,
G,H
1AQX0.87
2591-(methylsulfanyl)-4-nitrobenzeneX2RAZ0.71
PPNPARA-NITROPHENYLALANINEI1YTJ0.75
NST3-{[(3-NITROANILINE]SULFONYL}THIOPHENE-
2-CARBOXYLIC ACID
B1XGI0.73
TPY(2S,3S)-3-FORMYL-2-({[(4-NITROPHENYL)SULFONYL]AMINO}METHYL)PENTANOIC ACIDB1E360.75
TPY(2S,3S)-3-FORMYL-2-({[(4-NITROPHENYL)SULFONYL]AMINO}METHYL)PENTANOIC ACIDB1E370.75
TPY(2S,3S)-3-FORMYL-2-({[(4-NITROPHENYL)SULFONYL]AMINO}METHYL)PENTANOIC ACIDB1E380.75