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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02320716

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
DRG5,6-DIHYDRO-BENZO[H]CINNOLIN-3-
YLAMINE
A1P4F0.72
34A3,4-DIMETHYLANILINEA1L4K0.84
1AN2-FLUOROANILINEA1LGW0.72
IS2[(4-ETHYLPHENYL)AMINO]CARBONYLPHOSPHONIC ACIDA1O4J0.7
PRLPROFLAVINH,I1BCU0.73
PRLPROFLAVINA,B,D,E1QVT0.73
PRLPROFLAVINA,B2KD40.73
PRLPROFLAVINA1QVU0.73
THATACRINEA,B2AOW0.71
THATACRINEA,B,C,D,E,F1MX10.71
THATACRINEA,B2AOX0.71
THATACRINEA1ACJ0.71
MGRMALACHITE GREENA,B3BQZ0.8
MGRMALACHITE GREENA1Q8N0.8
MGRMALACHITE GREENA,B3BR00.8
MGRMALACHITE GREENA,D,E3BTL0.8
MGRMALACHITE GREENA,B,D,E3BTC0.8
MGRMALACHITE GREENA,B,D,E1JUP0.8
GP61-(4-AMIDINOPHENYL)-3-(4-CHLOROPHENYL)UREAA1BJU0.72
DSM3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-
5-YL)-N-METHYLPROPAN-1-AMINE
A2QJU0.73
DSM3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-
5-YL)-N-METHYLPROPAN-1-AMINE
A2QB40.73
UA5(4-ETHYLPHENYL)SULFAMIC ACIDA,B2I5X0.79
B2Y1-biphenyl-2-ylmethanamineA,B,C,D3CCB0.74
ZAT4,4'-DIACETYLDIPHENYLUREA-BIS(GUANYLHYDRAZONE)A2W0J0.73
TFMS-ETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]ISOTHIOUREAA,B1K2U0.72
TPM2-(4-AMINOBENZYLAMINO)-3,4,5,6-
TETRAHYDROPYRIDINIUM
J,K,L1F3D0.74
AHC4-AMINOHYDROCINNAMIC ACIDA,B2AY10.7
2CM2-CHLORO-6-METHYL-ANILINEA1OVH0.7
U125-IMINO-4-(3-TRIFLUOROMETHYL-PHENYLAZO)-
5H-PYRAZOL-3-YLAMINE
A2GG20.75
FLM3-FLUORO-2-METHYL-ANILINEA1OVJ0.79
IDMINDOLINEA,B3CEP0.71
IDMINDOLINEA1AEK0.71
BENBENZAMIDINEA2TIO0.75
BENBENZAMIDINEA1J150.75
BENBENZAMIDINEA,B3BEU0.75
BENBENZAMIDINET1V2U0.75
BENBENZAMIDINEA,B,C,D,E,F3CF80.75
BENBENZAMIDINEA1S0R0.75
BENBENZAMIDINEA,B1V160.75
BENBENZAMIDINEA1CC70.75
BENBENZAMIDINEA3BG80.75
BENBENZAMIDINEA1CC80.75
BENBENZAMIDINEA3PTB0.75
BENBENZAMIDINEA,B1TRM0.75
BENBENZAMIDINEA1ZHR0.75
BENBENZAMIDINEA,B,C,D,E,F1NKZ0.75
BENBENZAMIDINEA2BLV0.75
BENBENZAMIDINEA,B,C,D,E,F2GLP0.75
BENBENZAMIDINEH,I3D490.75
BENBENZAMIDINEH,L,T2AER0.75
BENBENZAMIDINEA1J140.75
BENBENZAMIDINEA1NSA0.75
BENBENZAMIDINEA2AYW0.75
BENBENZAMIDINEA1BRA0.75
BENBENZAMIDINEA,B,C,D1A0J0.75
BENBENZAMIDINEB,C,D2AST0.75
BENBENZAMIDINEA,B2CKR0.75
BENBENZAMIDINEA1LPU0.75
BENBENZAMIDINEA1ZHM0.75
BENBENZAMIDINEA1J8A0.75
BENBENZAMIDINEA,B3BCX0.75
BENBENZAMIDINEA,B,C,D,E,F3CF90.75
BENBENZAMIDINEA,B,C,D,E,F3D040.75
BENBENZAMIDINEA,B,C,D,E,F2GLL0.75
BENBENZAMIDINEA1AND0.75
BENBENZAMIDINEA2TBS0.75
BENBENZAMIDINEA,B,C,D,E,F3DP20.75
BENBENZAMIDINET1V2M0.75
BENBENZAMIDINEA2EEK0.75
BENBENZAMIDINEH,I2ZI20.75
BENBENZAMIDINET1V2J0.75
BENBENZAMIDINEH1KLI0.75
BENBENZAMIDINEA1CE50.75
BENBENZAMIDINEA,B,C,D,E,F3B7J0.75
BENBENZAMIDINEB,Y2PKA0.75
BENBENZAMIDINEA2VJ00.75
BENBENZAMIDINEA3B3J0.75
BENBENZAMIDINEA,B,C,D,E,F3DOY0.75
BENBENZAMIDINEA,B,C,D,E,F3DP30.75
BENBENZAMIDINEA,B,C,D,E,F2GLM0.75
BENBENZAMIDINEA1ANB0.75
BENBENZAMIDINEA1LO60.75
BENBENZAMIDINEA1LR40.75
BENBENZAMIDINEA,B1V1M0.75
BENBENZAMIDINEA1ZHP0.75
BENBENZAMIDINEA2J9N0.75
BENBENZAMIDINEA2BMV0.75
BENBENZAMIDINEA,B2CKS0.75
BENBENZAMIDINEA2BLW0.75
BENBENZAMIDINEA1J160.75
BENBENZAMIDINEA,B1V110.75
BENBENZAMIDINEA,B,C,D,E,F3DP00.75
BENBENZAMIDINEB1RTF0.75
BENBENZAMIDINEA,B,C,D,E,F3DP10.75
BENBENZAMIDINEA,B,C,D2E580.75
BENBENZAMIDINEA2TRM0.75
BENBENZAMIDINET1V2V0.75
BENBENZAMIDINEA1MBQ0.75
BENBENZAMIDINEA,B,C,D,E,F3DOZ0.75
BENBENZAMIDINEA2O8U0.75
BENBENZAMIDINEH1DWB0.75
BENBENZAMIDINEB,C2ASS0.75
BENBENZAMIDINEA1ANE0.75
BENBENZAMIDINEH,I2ZIQ0.75
BENBENZAMIDINEA1BIT0.75
BENBENZAMIDINEA2AIQ0.75
BENBENZAMIDINEA2OQ50.75
BENBENZAMIDINEA1ANC0.75
BENBENZAMIDINEH1JBU0.75
BENBENZAMIDINEA,B2BPQ0.75
BENBENZAMIDINEA,B,C,D2GNN0.75
BENBENZAMIDINET1V2S0.75
BENBENZAMIDINEA1H4W0.75
BENBENZAMIDINEA1OSS0.75
BENBENZAMIDINEA1W800.75
BENBENZAMIDINEA1BTY0.75
BENBENZAMIDINEH,I2ZFQ0.75
BENBENZAMIDINEA1EAX0.75
BENBENZAMIDINEA1L2E0.75
BENBENZAMIDINEA1WRI0.75
BENBENZAMIDINEA,B3BB80.75
BENBENZAMIDINEA2OXS0.75
BENBENZAMIDINEA1DPO0.75
BENBENZAMIDINET1V2L0.75
ISOPARA-ISOPROPYLANILINEA1BMA0.86
ISOPARA-ISOPROPYLANILINEA,B1ELC0.86
ISOPARA-ISOPROPYLANILINEA,B1ELB0.86
ISOPARA-ISOPROPYLANILINEA,B1ELA0.86
PNZP-NITRO-BENZYLAMINEA,D,H2HJ40.74
PNZP-NITRO-BENZYLAMINEA,B2C700.74
5AN3,5-DIFLUOROANILINEA1LGX0.7
ANLANILINEA2OV40.75
ANLANILINEA1AEE0.75
ANLANILINEA1PPA0.75
ANLANILINEA1HJ90.75
CVICRYSTAL VIOLETA,B,D,E1JTX0.8
APBM-AMINOPHENYLBORONIC ACIDA,B3BLS0.73
AU44,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)A2PYZ0.78
PRY2-PROPYL-ANILINEA1OWY0.84
ANI4-TRIFLUOROMETHYLANILINEE,I1ELE0.8
ANI4-TRIFLUOROMETHYLANILINEE,I7EST0.8
ANI4-TRIFLUOROMETHYLANILINEE,I2EST0.8
ANI4-TRIFLUOROMETHYLANILINEE,I1ELD0.8
TRJMETA-DI(AMINOMETHYL)BENZENEA,I1GVV0.71
TRJMETA-DI(AMINOMETHYL)BENZENEA1FQ50.71
PHZ1-PHENYLHYDRAZINEA2E2T0.71
PHZ1-PHENYLHYDRAZINED,H2AGL0.71
BRNBERENILA,B268D0.86
BRNBERENILA,B1D630.86
BRNBERENILA,D,E2GBY0.86
BRNBERENILA2DBE0.86
BRNBERENILA2GVR0.86
DBP1,3-DIAMINOBENZYL PHENYLALANINEA1A850.81
PBZP-AMINO BENZAMIDINEA,B2BDG0.88
PBZP-AMINO BENZAMIDINEA1RFN0.88
PBZP-AMINO BENZAMIDINEA,B,C,D,E,F,
G,H,I,J,K,L,
M,N,O,P
2BDI0.88
PBZP-AMINO BENZAMIDINEA,B,C,D2BDH0.88
PBZP-AMINO BENZAMIDINEA1FIZ0.88
PBZP-AMINO BENZAMIDINEA1FIW0.88
PBZP-AMINO BENZAMIDINEH,L,T2A2Q0.88
ASR4-AMINOPHENYLARSONIC ACIDA1N4F0.73
ANCANTHRACEN-1-YLAMINEA,B1GT10.79
ANCANTHRACEN-1-YLAMINEA,B1HN20.79
AFF2-ACETYLAMINOFLUORENE-3-YLA2GE20.73
XYD2,5-DIMETHYLANILINEA,B,C,D1KYA0.81
XYD2,5-DIMETHYLANILINEA1L4L0.81
U195-IMINO-4-(2-TRIFLUOROMETHYL-PHENYLAZO)-
5H-PYRAZOL-3-YLAMINE
A2GG50.75
BAMBENZAMIDINEU1F5K0.75
BAMBENZAMIDINEX2BY80.75
BAMBENZAMIDINEB2PSM0.75
BAMBENZAMIDINEX2BY90.75
BAMBENZAMIDINEA1C1N0.75
BAMBENZAMIDINEX2BY60.75
BAMBENZAMIDINEH,I1C5O0.75
BAMBENZAMIDINEA1XX40.75
BAMBENZAMIDINEA1HJ80.75
BAMBENZAMIDINEA1C5P0.75
BAMBENZAMIDINEB1C5Z0.75
BAMBENZAMIDINEA,B1ZVW0.75
BAMBENZAMIDINEA2ANW0.75
BAMBENZAMIDINEA2ANY0.75
BAMBENZAMIDINEX2BYA0.75
BAMBENZAMIDINEA1TIO0.75
BAMBENZAMIDINEX2BY50.75
BAMBENZAMIDINEX2BY70.75
1504,5-DIMETHYL-1,2-PHENYLENEDIAMINEA1L4F0.81
IXX3-(5H-DIBENZO[B,F]AZEPIN-5-YL)-
N,N-DIMETHYLPROPAN-1-AMINE
A2Q720.72
9AP9-AMINOPHENANTHRENEA1EGY0.8