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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03260690

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
OXEORTHO-XYLENEA,B3E0X0.75
OXEORTHO-XYLENEA188L0.75
BENBENZAMIDINEA2TIO0.78
BENBENZAMIDINEA1J150.78
BENBENZAMIDINEA,B3BEU0.78
BENBENZAMIDINET1V2U0.78
BENBENZAMIDINEA,B,C,D,E,F3CF80.78
BENBENZAMIDINEA1S0R0.78
BENBENZAMIDINEA,B1V160.78
BENBENZAMIDINEA1CC70.78
BENBENZAMIDINEA3BG80.78
BENBENZAMIDINEA1CC80.78
BENBENZAMIDINEA3PTB0.78
BENBENZAMIDINEA,B1TRM0.78
BENBENZAMIDINEA1ZHR0.78
BENBENZAMIDINEA,B,C,D,E,F1NKZ0.78
BENBENZAMIDINEA2BLV0.78
BENBENZAMIDINEA,B,C,D,E,F2GLP0.78
BENBENZAMIDINEH,I3D490.78
BENBENZAMIDINEH,L,T2AER0.78
BENBENZAMIDINEA1J140.78
BENBENZAMIDINEA1NSA0.78
BENBENZAMIDINEA2AYW0.78
BENBENZAMIDINEA1BRA0.78
BENBENZAMIDINEA,B,C,D1A0J0.78
BENBENZAMIDINEB,C,D2AST0.78
BENBENZAMIDINEA,B2CKR0.78
BENBENZAMIDINEA1LPU0.78
BENBENZAMIDINEA1ZHM0.78
BENBENZAMIDINEA1J8A0.78
BENBENZAMIDINEA,B3BCX0.78
BENBENZAMIDINEA,B,C,D,E,F3CF90.78
BENBENZAMIDINEA,B,C,D,E,F3D040.78
BENBENZAMIDINEA,B,C,D,E,F2GLL0.78
BENBENZAMIDINEA1AND0.78
BENBENZAMIDINEA2TBS0.78
BENBENZAMIDINEA,B,C,D,E,F3DP20.78
BENBENZAMIDINET1V2M0.78
BENBENZAMIDINEA2EEK0.78
BENBENZAMIDINEH,I2ZI20.78
BENBENZAMIDINET1V2J0.78
BENBENZAMIDINEH1KLI0.78
BENBENZAMIDINEA1CE50.78
BENBENZAMIDINEA,B,C,D,E,F3B7J0.78
BENBENZAMIDINEB,Y2PKA0.78
BENBENZAMIDINEA2VJ00.78
BENBENZAMIDINEA3B3J0.78
BENBENZAMIDINEA,B,C,D,E,F3DOY0.78
BENBENZAMIDINEA,B,C,D,E,F3DP30.78
BENBENZAMIDINEA,B,C,D,E,F2GLM0.78
BENBENZAMIDINEA1ANB0.78
BENBENZAMIDINEA1LO60.78
BENBENZAMIDINEA1LR40.78
BENBENZAMIDINEA,B1V1M0.78
BENBENZAMIDINEA1ZHP0.78
BENBENZAMIDINEA2J9N0.78
BENBENZAMIDINEA2BMV0.78
BENBENZAMIDINEA,B2CKS0.78
BENBENZAMIDINEA2BLW0.78
BENBENZAMIDINEA1J160.78
BENBENZAMIDINEA,B1V110.78
BENBENZAMIDINEA,B,C,D,E,F3DP00.78
BENBENZAMIDINEB1RTF0.78
BENBENZAMIDINEA,B,C,D,E,F3DP10.78
BENBENZAMIDINEA,B,C,D2E580.78
BENBENZAMIDINEA2TRM0.78
BENBENZAMIDINET1V2V0.78
BENBENZAMIDINEA1MBQ0.78
BENBENZAMIDINEA,B,C,D,E,F3DOZ0.78
BENBENZAMIDINEA2O8U0.78
BENBENZAMIDINEH1DWB0.78
BENBENZAMIDINEB,C2ASS0.78
BENBENZAMIDINEA1ANE0.78
BENBENZAMIDINEH,I2ZIQ0.78
BENBENZAMIDINEA1BIT0.78
BENBENZAMIDINEA2AIQ0.78
BENBENZAMIDINEA2OQ50.78
BENBENZAMIDINEA1ANC0.78
BENBENZAMIDINEH1JBU0.78
BENBENZAMIDINEA,B2BPQ0.78
BENBENZAMIDINEA,B,C,D2GNN0.78
BENBENZAMIDINET1V2S0.78
BENBENZAMIDINEA1H4W0.78
BENBENZAMIDINEA1OSS0.78
BENBENZAMIDINEA1W800.78
BENBENZAMIDINEA1BTY0.78
BENBENZAMIDINEH,I2ZFQ0.78
BENBENZAMIDINEA1EAX0.78
BENBENZAMIDINEA1L2E0.78
BENBENZAMIDINEA1WRI0.78
BENBENZAMIDINEA,B3BB80.78
BENBENZAMIDINEA2OXS0.78
BENBENZAMIDINEA1DPO0.78
BENBENZAMIDINET1V2L0.78
PBN4-PHENYLBUTYLAMINEA1TNI0.76
PBN4-PHENYLBUTYLAMINEA1UTP0.76
FRD1-PHENYL-2-AMINOPROPANEA,C2AOI0.77
FRD1-PHENYL-2-AMINOPROPANEA,B,C2AOF0.77
FRD1-PHENYL-2-AMINOPROPANEA,B,C2AOJ0.77
FRD1-PHENYL-2-AMINOPROPANEA,B,C2AOH0.77
PRA3-PHENYLPROPYLAMINEA1TNK0.76
PRA3-PHENYLPROPYLAMINEM1UTL0.76
PEA2-PHENYLETHYLAMINEA,B,E,F,G,H1MHW0.75
PEA2-PHENYLETHYLAMINEA1TNJ0.75
PEA2-PHENYLETHYLAMINED,H2HKM0.75
PEA2-PHENYLETHYLAMINEA1UTO0.75
PEA2-PHENYLETHYLAMINEA,B1D6Y0.75
PEA2-PHENYLETHYLAMINEA,B1D6Z0.75
PEA2-PHENYLETHYLAMINEA,B1D6U0.75
PEA2-PHENYLETHYLAMINEA1UTM0.75
TRJMETA-DI(AMINOMETHYL)BENZENEA,I1GVV0.72
TRJMETA-DI(AMINOMETHYL)BENZENEA1FQ50.72
4CM(4-CARBAMIMIDOYLPHENYL)-METHYL-
PHOSPHINIC ACID
A1TX70.71
PXYPARA-XYLENEA187L0.75
PXYPARA-XYLENEA225L0.75
2631-(azidomethyl)-3-methylbenzeneX2RB20.7
1PB1,4-DIPHENYL-2-BUTENEA,B1OJ90.71
MFG(1Z)-4-(4-FLUOROPHENYL)-2-METHYLIDENEBUTAN-
1-IMINE
A,B2VZ20.77
ABNBENZYLAMINED,H2HXC0.71
ABNBENZYLAMINEA,I1A860.71
ABNBENZYLAMINEA1UTN0.71
ABNBENZYLAMINEA1N6X0.71
ABNBENZYLAMINEA2BZA0.71
ABNBENZYLAMINEA2EUS0.71
ABNBENZYLAMINEA1N6Y0.71
ABNBENZYLAMINEA1UTJ0.71
FPRPROPYLBENZENEC1RHK0.77
2HT3-methylbenzonitrileA,B3F880.7
I4BISOBUTYLBENZENEA184L0.75
MBNTOLUENEA,B3D7O0.74
MBNTOLUENEA,B1R1X0.74
MBNTOLUENEA,B1JLX0.74
MBNTOLUENEA,B,C,D3D170.74
MBNTOLUENEA,B2VRL0.74
MBNTOLUENEA,I2Z3E0.74
MBNTOLUENEA,B1YZI0.74
MBNTOLUENEA,B2DN10.74
MBNTOLUENEA,B3EN10.74
B2FPHENYLALANINE BORONIC ACIDA,P1GBM0.73
B2FPHENYLALANINE BORONIC ACIDA,P1GBD0.73
B2FPHENYLALANINE BORONIC ACIDA,P1P060.73
B2FPHENYLALANINE BORONIC ACIDA,P1GBI0.73
B2FPHENYLALANINE BORONIC ACIDA,P8LPR0.73
TPATRANS-2-PHENYLCYCLOPROPYLAMINEA1TNL0.71
2671-(azidomethyl)-3-methylbenzeneA2RBQ0.7
BAMBENZAMIDINEU1F5K0.78
BAMBENZAMIDINEX2BY80.78
BAMBENZAMIDINEB2PSM0.78
BAMBENZAMIDINEX2BY90.78
BAMBENZAMIDINEA1C1N0.78
BAMBENZAMIDINEX2BY60.78
BAMBENZAMIDINEH,I1C5O0.78
BAMBENZAMIDINEA1XX40.78
BAMBENZAMIDINEA1HJ80.78
BAMBENZAMIDINEA1C5P0.78
BAMBENZAMIDINEB1C5Z0.78
BAMBENZAMIDINEA,B1ZVW0.78
BAMBENZAMIDINEA2ANW0.78
BAMBENZAMIDINEA2ANY0.78
BAMBENZAMIDINEX2BYA0.78
BAMBENZAMIDINEA1TIO0.78
BAMBENZAMIDINEX2BY50.78
BAMBENZAMIDINEX2BY70.78
NFP3-AMINO-5-PHENYLPENTANEA1MEM0.76
NFP3-AMINO-5-PHENYLPENTANEA,D,E1FH00.76
4BT2-{2-[4-(2-CARBAMIMIDOYLSULFANYL-
ETHYL)-PHENYL]-ETHYL}-ISOTHIOUREA
A,B1D1X0.73
3BT2-{2-[3-(2-CARBAMIMIDOYLSULFANYL-
ETHYL)-PHENYL]-ETHYL}-ISOTHIOUREA
A,B1D1Y0.73
N4BN-BUTYLBENZENEA186L0.77
PYLPHENYLETHANEC1B070.77
PYLPHENYLETHANEA,B2VRM0.77
PYLPHENYLETHANEA1NHB0.77
PBAPHENYLETHANE BORONIC ACIDC,G6CHA0.73
PO01-BENZYL-(R)-PROPYLAMINEA,I1LZQ0.77
PO01-BENZYL-(R)-PROPYLAMINEB,I1M0B0.77