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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03330091

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2671-(azidomethyl)-3-methylbenzeneA2RBQ0.76
FRD1-PHENYL-2-AMINOPROPANEA,C2AOI0.72
FRD1-PHENYL-2-AMINOPROPANEA,B,C2AOF0.72
FRD1-PHENYL-2-AMINOPROPANEA,B,C2AOJ0.72
FRD1-PHENYL-2-AMINOPROPANEA,B,C2AOH0.72
0071-METHYLAMINE-1-BENZYL-CYCLOPENTANEA,B,C,D2BUA0.71
BENBENZAMIDINEA2TIO0.72
BENBENZAMIDINEA1J150.72
BENBENZAMIDINEA,B3BEU0.72
BENBENZAMIDINET1V2U0.72
BENBENZAMIDINEA,B,C,D,E,F3CF80.72
BENBENZAMIDINEA1S0R0.72
BENBENZAMIDINEA,B1V160.72
BENBENZAMIDINEA1CC70.72
BENBENZAMIDINEA3BG80.72
BENBENZAMIDINEA1CC80.72
BENBENZAMIDINEA3PTB0.72
BENBENZAMIDINEA,B1TRM0.72
BENBENZAMIDINEA1ZHR0.72
BENBENZAMIDINEA,B,C,D,E,F1NKZ0.72
BENBENZAMIDINEA2BLV0.72
BENBENZAMIDINEA,B,C,D,E,F2GLP0.72
BENBENZAMIDINEH,I3D490.72
BENBENZAMIDINEH,L,T2AER0.72
BENBENZAMIDINEA1J140.72
BENBENZAMIDINEA1NSA0.72
BENBENZAMIDINEA2AYW0.72
BENBENZAMIDINEA1BRA0.72
BENBENZAMIDINEA,B,C,D1A0J0.72
BENBENZAMIDINEB,C,D2AST0.72
BENBENZAMIDINEA,B2CKR0.72
BENBENZAMIDINEA1LPU0.72
BENBENZAMIDINEA1ZHM0.72
BENBENZAMIDINEA1J8A0.72
BENBENZAMIDINEA,B3BCX0.72
BENBENZAMIDINEA,B,C,D,E,F3CF90.72
BENBENZAMIDINEA,B,C,D,E,F3D040.72
BENBENZAMIDINEA,B,C,D,E,F2GLL0.72
BENBENZAMIDINEA1AND0.72
BENBENZAMIDINEA2TBS0.72
BENBENZAMIDINEA,B,C,D,E,F3DP20.72
BENBENZAMIDINET1V2M0.72
BENBENZAMIDINEA2EEK0.72
BENBENZAMIDINEH,I2ZI20.72
BENBENZAMIDINET1V2J0.72
BENBENZAMIDINEH1KLI0.72
BENBENZAMIDINEA1CE50.72
BENBENZAMIDINEA,B,C,D,E,F3B7J0.72
BENBENZAMIDINEB,Y2PKA0.72
BENBENZAMIDINEA2VJ00.72
BENBENZAMIDINEA3B3J0.72
BENBENZAMIDINEA,B,C,D,E,F3DOY0.72
BENBENZAMIDINEA,B,C,D,E,F3DP30.72
BENBENZAMIDINEA,B,C,D,E,F2GLM0.72
BENBENZAMIDINEA1ANB0.72
BENBENZAMIDINEA1LO60.72
BENBENZAMIDINEA1LR40.72
BENBENZAMIDINEA,B1V1M0.72
BENBENZAMIDINEA1ZHP0.72
BENBENZAMIDINEA2J9N0.72
BENBENZAMIDINEA2BMV0.72
BENBENZAMIDINEA,B2CKS0.72
BENBENZAMIDINEA2BLW0.72
BENBENZAMIDINEA1J160.72
BENBENZAMIDINEA,B1V110.72
BENBENZAMIDINEA,B,C,D,E,F3DP00.72
BENBENZAMIDINEB1RTF0.72
BENBENZAMIDINEA,B,C,D,E,F3DP10.72
BENBENZAMIDINEA,B,C,D2E580.72
BENBENZAMIDINEA2TRM0.72
BENBENZAMIDINET1V2V0.72
BENBENZAMIDINEA1MBQ0.72
BENBENZAMIDINEA,B,C,D,E,F3DOZ0.72
BENBENZAMIDINEA2O8U0.72
BENBENZAMIDINEH1DWB0.72
BENBENZAMIDINEB,C2ASS0.72
BENBENZAMIDINEA1ANE0.72
BENBENZAMIDINEH,I2ZIQ0.72
BENBENZAMIDINEA1BIT0.72
BENBENZAMIDINEA2AIQ0.72
BENBENZAMIDINEA2OQ50.72
BENBENZAMIDINEA1ANC0.72
BENBENZAMIDINEH1JBU0.72
BENBENZAMIDINEA,B2BPQ0.72
BENBENZAMIDINEA,B,C,D2GNN0.72
BENBENZAMIDINET1V2S0.72
BENBENZAMIDINEA1H4W0.72
BENBENZAMIDINEA1OSS0.72
BENBENZAMIDINEA1W800.72
BENBENZAMIDINEA1BTY0.72
BENBENZAMIDINEH,I2ZFQ0.72
BENBENZAMIDINEA1EAX0.72
BENBENZAMIDINEA1L2E0.72
BENBENZAMIDINEA1WRI0.72
BENBENZAMIDINEA,B3BB80.72
BENBENZAMIDINEA2OXS0.72
BENBENZAMIDINEA1DPO0.72
BENBENZAMIDINET1V2L0.72
RM1N-METHYL-1(R)-AMINOINDANA,B2C670.7
RMAN-[(1S)-2,3-DIHYDRO-1H-INDEN-1-
YL]-N-METHYL-N-PROP-2-YNYLAMINE
A,B1S3B0.7
745TRANS-6-(2-PHENYLCYCLOPROPYL)-NAPHTHALENE-
2-CARBOXAMIDINE
A1U6Q0.72
BTMN-benzyl-N,N-diethylethanaminiumA,B2Q9Y0.75
TRJMETA-DI(AMINOMETHYL)BENZENEA,I1GVV0.73
TRJMETA-DI(AMINOMETHYL)BENZENEA1FQ50.73
MFG(1Z)-4-(4-FLUOROPHENYL)-2-METHYLIDENEBUTAN-
1-IMINE
A,B2VZ20.72
PHCN-METHYL-N-(METHYLBENZYL)FORMAMIDEA,B1BIM0.71
PHCN-METHYL-N-(METHYLBENZYL)FORMAMIDEA,B1BIL0.71
PEA2-PHENYLETHYLAMINEA,B,E,F,G,H1MHW0.7
PEA2-PHENYLETHYLAMINEA1TNJ0.7
PEA2-PHENYLETHYLAMINED,H2HKM0.7
PEA2-PHENYLETHYLAMINEA1UTO0.7
PEA2-PHENYLETHYLAMINEA,B1D6Y0.7
PEA2-PHENYLETHYLAMINEA,B1D6Z0.7
PEA2-PHENYLETHYLAMINEA,B1D6U0.7
PEA2-PHENYLETHYLAMINEA1UTM0.7
NFP3-AMINO-5-PHENYLPENTANEA1MEM0.73
NFP3-AMINO-5-PHENYLPENTANEA,D,E1FH00.73
1PC1-(PHENYL-1-CYCLOHEXYL)PIPERIDINEB,C2PCP0.8
CVICRYSTAL VIOLETA,B,D,E1JTX0.72
DPKDEPRENYLA,B2BYB0.75
CGQ3-[C-[N'-(3-CARBAMIMIDOYL-BENZYLIDENIUM)-
HYDRAZINO]-[[AMINOMETHYLIDENE]AMINIUM]-
IMINOMETHYL]-BENZAMIDINIUM
A,B,D,E2G0E0.76
CGQ3-[C-[N'-(3-CARBAMIMIDOYL-BENZYLIDENIUM)-
HYDRAZINO]-[[AMINOMETHYLIDENE]AMINIUM]-
IMINOMETHYL]-BENZAMIDINIUM
A,B1M6F0.76
BAMBENZAMIDINEU1F5K0.72
BAMBENZAMIDINEX2BY80.72
BAMBENZAMIDINEB2PSM0.72
BAMBENZAMIDINEX2BY90.72
BAMBENZAMIDINEA1C1N0.72
BAMBENZAMIDINEX2BY60.72
BAMBENZAMIDINEH,I1C5O0.72
BAMBENZAMIDINEA1XX40.72
BAMBENZAMIDINEA1HJ80.72
BAMBENZAMIDINEA1C5P0.72
BAMBENZAMIDINEB1C5Z0.72
BAMBENZAMIDINEA,B1ZVW0.72
BAMBENZAMIDINEA2ANW0.72
BAMBENZAMIDINEA2ANY0.72
BAMBENZAMIDINEX2BYA0.72
BAMBENZAMIDINEA1TIO0.72
BAMBENZAMIDINEX2BY50.72
BAMBENZAMIDINEX2BY70.72
L18(2S)-1-methyl-2-[(2S,4R)-2-methyl-
4-phenylpentyl]piperidine
A2JJG0.75
MGRMALACHITE GREENA,B3BQZ0.72
MGRMALACHITE GREENA1Q8N0.72
MGRMALACHITE GREENA,B3BR00.72
MGRMALACHITE GREENA,D,E3BTL0.72
MGRMALACHITE GREENA,B,D,E3BTC0.72
MGRMALACHITE GREENA,B,D,E1JUP0.72
2631-(azidomethyl)-3-methylbenzeneX2RB20.76
271N-methyl-1-phenylmethanamineX2RBT0.72
ABNBENZYLAMINED,H2HXC0.72
ABNBENZYLAMINEA,I1A860.72
ABNBENZYLAMINEA1UTN0.72
ABNBENZYLAMINEA1N6X0.72
ABNBENZYLAMINEA2BZA0.72
ABNBENZYLAMINEA2EUS0.72
ABNBENZYLAMINEA1N6Y0.72
ABNBENZYLAMINEA1UTJ0.72
B2Y1-biphenyl-2-ylmethanamineA,B,C,D3CCB0.79
PO01-BENZYL-(R)-PROPYLAMINEA,I1LZQ0.72
PO01-BENZYL-(R)-PROPYLAMINEB,I1M0B0.72
TPATRANS-2-PHENYLCYCLOPROPYLAMINEA1TNL0.7