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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01499037

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
368(1R)-2-{[AMINO(IMINO)METHYL]AMINO}-
1-{4-[(4R)-4-(HYDROXYMETHYL)-1,3,2-
DIOXABOROLAN-2-YL]PHENYL}ETHYL NICOTINATE
A1ZLR0.72
DRC9-AMINO-N-[2-(4-MORPHOLINYL)ETHYL]-
4-ACRIDINECARBOXAMIDE
A1KCI0.71
CMM2-[2-(1-CARBAMIMIDOYL-PIPERIDIN-
3-YL)-ACETYLAMINO]-3-{4-[2-(3-OXALYL-
1H-INDOL-7-YL)ETHYL]-PHENYL}-PROPIONIC ACID METHYL ESTER
A,B1M490.73
B49N-[2-(diethylamino)ethyl]-5-[(Z)-
(5-fluoro-2-oxo-1,2-dihydro-3H-
indol-3-ylidene)methyl]-2,4-dimethyl-
1H-pyrrole-3-carboxamide
A,B3G0F0.7
B49N-[2-(diethylamino)ethyl]-5-[(Z)-
(5-fluoro-2-oxo-1,2-dihydro-3H-
indol-3-ylidene)methyl]-2,4-dimethyl-
1H-pyrrole-3-carboxamide
A3G0E0.7
1177-[2-(4-FLUORO-PHENYL)-5-ISOPROPYL-
3-PHENYL-4-PHENYLCARBAMOYL-PYRROL-
1-YL]- 3,5-DIHYDROXY-HEPTANOIC ACID
A,B,C,D1HWK0.75
8CA9-benzyl-2,3,4,9-tetrahydro-1H-
carbazole-8-carboxylic acid
A3FR20.71
IMS2-[1-(4-CHLOROBENZOYL)-5-METHOXY-
2-METHYL-1H-INDOL-3-YL]-N-[(1S)-
1-(HYDROXYMETHYL)PROPYL]ACETAMIDE
P2OYU0.71
I4A5-(3-carbamoylbenzyl)-5,6,7,8,9,10-
hexahydrocyclohepta[b]indole-4-
carboxylic acid
A3FR50.73
2S8(2S)-8-[(tert-butoxycarbonyl)amino]-
2-(1H-indol-3-yl)octanoic acid
B3C6N0.71
5702-(2-BENZOYL-PHENYLAMINO)-3-{4-
[2-(5-METHYL-2-PHENYL-OXAZOL-4-
YL)-ETHOXY]-PHENYL}-PROPIONIC ACID
A,D1RDT0.71
5702-(2-BENZOYL-PHENYLAMINO)-3-{4-
[2-(5-METHYL-2-PHENYL-OXAZOL-4-
YL)-ETHOXY]-PHENYL}-PROPIONIC ACID
A,D1FM90.71
IM82-[1-(4-CHLOROBENZOYL)-5-METHOXY-
2-METHYL-1H-INDOL-3-YL]-N-[(1R)-
1-(HYDROXYMETHYL)PROPYL]ACETAMIDE
P2OYE0.71
POO3-CYCLOHEXYL-1-(2-{METHYL[(1-METHYLPIPERIDIN-
3-YL)METHYL]AMINO}-2-OXOETHYL)-
2-PHENYL-1H-INDOLE-6-CARBOXYLIC ACID
A2BRL0.7
C80(2S,4S,5R,7R)-4-AMINO-8-(BUTYLAMINO)-
5-HYDROXY-2,7-DIMETHYL-8-OXOOCTYL 1-
BENZYL-1H-INDOLE-3-CARBOXYLATE
C,O2V110.76
KAWN-{(5S)-4,4-dihydroxy-6-phenyl-
5-[(phenylcarbonyl)amino]hexanoyl}-
L-tryptophan
A3BKL0.71
PHOPHEOPHYTIN AA,B,C,D,F,H,
K,L,T,V,Z
3A0H0.71
PHOPHEOPHYTIN AZ1W5C0.71
PHOPHEOPHYTIN AA,B,C,D,F,H,
I,K,L,M,T,V,X
2AXT0.71
PHOPHEOPHYTIN AA,B,C,D,E,H,
J,K,L,T,V,Z
3A0B0.71
PHOPHEOPHYTIN AA,B,C,D,E,F,
H,I,J,K,M,O,
T,V,Z
3BZ10.71
PHOPHEOPHYTIN A0,A,B,C,D,E,
G,J,K,L,M,N,
P,R,V,W
1IZL0.71
PHOPHEOPHYTIN AA,B,C,D,E,F,
J,K,V
1S5L0.71
PHOPHEOPHYTIN AA,B,C,D,F,G,
H,I,J,K,L,M,
O,P,Q,R
1ILX0.71
PHOPHEOPHYTIN AA,B,C,D,F,G,
H,I,J,K,L,M,
O,P,Q,R
1FE10.71
PHOPHEOPHYTIN AA,B,C,D,E,F,
H,I,J,K,L,M,
O,T,V,X,Z
3BZ20.71
OAI6-(OXALYL-AMINO)-1H-INDOLE-5-CARBOXYLIC ACIDA1C830.73
3CS3-[3-(3,3-DIMETHYLBUTANOYL)-1-(4-
IODOBENZYL)-5-(QUINOLIN-2-YLMETHOXY)-
1H-INDOL-2-YL]-2,2-DIMETHYLPROPANOIC ACID
A,B,C,D,E,F2Q7R0.71
6IN4-(1-BENZYL-3-CARBAMOYLMETHYL-2-
METHYL-1H-INDOL-5-YLOXY)-BUTYRIC ACID
A1DB50.73
LI33-FLUORO-N-1H-INDOL-5-YL-5-MORPHOLIN-
4-YLBENZAMIDE
A1WBV0.71
1103-(4-AMINO-CYCLOHEXYL)-2-HYDROXY-
3-[(4-OXO-2-PHENYLMETHANESULFONYL-
1,2,3,4-TETRAHYDRO-PYRROLO[1,2-
A]PYRAZINE-6-CARBONYL)-AMINO]-PROPIONIC ACID BUTYL ESTER
A1G370.71
1IQ2-(4-ISOPROPYL-4-METHYL-5-OXO-4,5-
DIHYDRO-1H-IMIDAZOL-2-YL)QUINOLINE-
3-CARBOXYLIC ACID
A1Z8N0.71
EHD4-ETHYL-4-HYDROXY-1,12-DIHYDRO-
4H-2-OXA-6,12A-DIAZA-DIBENZO[B,H]FLUORENE-
3,13-DIONE
A,C,D1T8I0.7
JTPN-[(13-CYCLOHEXYL-6,7-DIHYDROINDOLO[1,2-
D][1,4]BENZOXAZEPIN-10-YL)CARBONYL]-
2-METHYL-L-ALANINE
A,B2DXS0.73
GW4N-[(2S)-2-[(2-BENZOYLPHENYL)AMINO]-
3-{4-[2-(5-METHYL-2-PHENYL-1,3-
OXAZOL-4-YL)ETHOXY]PHENYL}PROPYL]ACETAMIDE
A,B2POB0.71
7HI(3R,5R)-7-[3-(biphenyl-4-ylcarbamoyl)-
2-ethyl-5,6,7,8-tetrahydrocyclohepta[b]pyrrol-
1(4H)-yl]-3,5-dihydroxyheptanoic acid
A,B,C,D3CD50.76
8IN[3-(1-BENZYL-3-CARBAMOYLMETHYL-
2-METHYL-1H-INDOL-5-YLOXY)-PROPYL-
]-PHOSPHONIC ACID
A1DB40.7
IIDN-(1-ISOPROPYLPIPERIDIN-4-YL)-1-
(3-METHOXYBENZYL)-1H-INDOLE-2-CARBOXAMIDE
A,B2BQ70.7
IQA(5-OXO-5,6-DIHYDRO-INDOLO[1,2-A]QUINAZOLIN-
7-YL)-ACETIC ACID
A1OM10.7
3405-METHOXY-1,2-DIMETHYL-3-(PHENOXYMETHYL)INDOLE-
4,7-DIONE
A,B,C,D1KBO0.71
CMF3-CYCLOHEXYL-1-(2-MORPHOLIN-4-YL-
2-OXOETHYL)-2-PHENYL-1H-INDOLE-
6-CARBOXYLIC ACID
A2BRK0.74
SU13-[(3-(2-CARBOXYETHYL)-4-METHYLPYRROL-
2-YL)METHYLENE]-2-INDOLINONE
A,B1FGI0.71
T19PHENYLMETHYLENECARBOXY-(METHYLENEAMINO-
FORMYL-DIPHENYLMETHYL)METHY-PRO-
BOROVAL
H,I1AIX0.73
CBB1-(3-CARBAMIMIDOYL-BENZYL)-1H-INDOLE-
2-CARBOXYLIC ACID 3-CARBAMIMIDOYL-
BENZYLESTER
B1LPK0.77
SNX2-[(2-methoxyethyl)amino]-4-(4-
oxo-1,2,3,4-tetrahydro-9H-carbazol-
9-yl)benzamide
A3D0B0.75
IMM1-(4-IODOBENZOYL)-5-METHOXY-2-METHYL INDOLE-
3-ACETIC ACID
A,B1PGF0.71
IMM1-(4-IODOBENZOYL)-5-METHOXY-2-METHYL INDOLE-
3-ACETIC ACID
A,B1PGG0.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M3PRC0.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M6PRC0.71
BPBBACTERIOPHEOPHYTIN BH,L,M1RY50.71
BPBBACTERIOPHEOPHYTIN BH,L,M1RZH0.71
BPBBACTERIOPHEOPHYTIN BL,M,R,S1RZZ0.71
BPBBACTERIOPHEOPHYTIN BL,M,R,S1S000.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M2JBL0.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M1VRN0.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M7PRC0.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M2PRC0.71
BPBBACTERIOPHEOPHYTIN BH,L,M1UMX0.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M1R2C0.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M3D380.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M2I5N0.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M5PRC0.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M1PRC0.71
BPBBACTERIOPHEOPHYTIN BH,L,M1RVJ0.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M,U1DXR0.71
ICO1H-INDOLE-3-CARBOXYLIC ACIDL2PIP0.71
RXB(1S)-2-oxo-1-phenyl-2-[(1,3,4-trioxo-
1,2,3,4-tetrahydroisoquinolin-5-
yl)amino]ethyl acetate
A,B,C,D3DEI0.71
ARH3-(HYDROXYMETHYL)-1-METHYL-5-(2-
METHYLAZIRIDIN-1-YL)-2-PHENYL-1H-
INDOLE-4,7-DIONE
A,B,C,D1H690.72
BPHBACTERIOPHEOPHYTIN AH,L,M1RG50.71
BPHBACTERIOPHEOPHYTIN AH,L,M2UWT0.71
BPHBACTERIOPHEOPHYTIN A1,2,3,5,6,7,
8,A,B,D,E,F,
G,H,I,J,K,L,
M,N,P,R,S,T,
U,V,W,Y
1PYH0.71
BPHBACTERIOPHEOPHYTIN AA,B,C1Z9K0.71
BPHBACTERIOPHEOPHYTIN AH,L,M2UXK0.71
BPHBACTERIOPHEOPHYTIN AH,L,M1RY50.71
BPHBACTERIOPHEOPHYTIN AH,L,M1RZH0.71
BPHBACTERIOPHEOPHYTIN AC,H,L,M1EYS0.71
BPHBACTERIOPHEOPHYTIN AH,L,M2UWS0.71
BPHBACTERIOPHEOPHYTIN AL,M4RCR0.71
BPHBACTERIOPHEOPHYTIN AH,L,M1K6N0.71
BPHBACTERIOPHEOPHYTIN AL,M1YF60.71
BPHBACTERIOPHEOPHYTIN AH,L,M2UX50.71
BPHBACTERIOPHEOPHYTIN AH,L,M3DTS0.71
BPHBACTERIOPHEOPHYTIN AC1E140.71
BPHBACTERIOPHEOPHYTIN AH,L,M3DTA0.71
BPHBACTERIOPHEOPHYTIN AL,M1PST0.71
BPHBACTERIOPHEOPHYTIN AL,M1KBY0.71
BPHBACTERIOPHEOPHYTIN AC,H,L,M1L9B0.71
BPHBACTERIOPHEOPHYTIN AL,M2RCR0.71
BPHBACTERIOPHEOPHYTIN AL,M1PCR0.71
BPHBACTERIOPHEOPHYTIN AL,M1M3X0.71
BPHBACTERIOPHEOPHYTIN AH,L,M2HJ60.71
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DS80.71
BPHBACTERIOPHEOPHYTIN AH,L,M1FNQ0.71
BPHBACTERIOPHEOPHYTIN AH,L,M2UXJ0.71
BPHBACTERIOPHEOPHYTIN AL,M1QOV0.71
BPHBACTERIOPHEOPHYTIN AH,L,M3DU30.71
BPHBACTERIOPHEOPHYTIN AH,L,M2UX40.71
BPHBACTERIOPHEOPHYTIN AL,M,R,S1AIJ0.71
BPHBACTERIOPHEOPHYTIN AL,M,N,O1AIG0.71
BPHBACTERIOPHEOPHYTIN AH,L,M1RGN0.71
BPHBACTERIOPHEOPHYTIN AL,M1JGX0.71
BPHBACTERIOPHEOPHYTIN AH,L,M2UWV0.71
BPHBACTERIOPHEOPHYTIN AH,L,M1RQK0.71
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DV60.71
BPHBACTERIOPHEOPHYTIN AH,L,M2UWW0.71
BPHBACTERIOPHEOPHYTIN AL,M,R,S1RZZ0.71
BPHBACTERIOPHEOPHYTIN AL,M,R,S1S000.71
BPHBACTERIOPHEOPHYTIN AH,L,M2HG30.71
BPHBACTERIOPHEOPHYTIN AH,L,M2UX30.71
BPHBACTERIOPHEOPHYTIN AL,M1OGV0.71
BPHBACTERIOPHEOPHYTIN AH,L,M3DUQ0.71
BPHBACTERIOPHEOPHYTIN AA,B1Z9J0.71
BPHBACTERIOPHEOPHYTIN AH,L,M2GNU0.71
BPHBACTERIOPHEOPHYTIN AC1E6D0.71
BPHBACTERIOPHEOPHYTIN AL,M1MPS0.71
BPHBACTERIOPHEOPHYTIN AL,M,X2UXM0.71
BPHBACTERIOPHEOPHYTIN AH,L,M1RVJ0.71
BPHBACTERIOPHEOPHYTIN AH,L,M2UXL0.71
BPHBACTERIOPHEOPHYTIN AC,D,L,M,R,S1L9J0.71
BPHBACTERIOPHEOPHYTIN AL,M2JJ00.71
BPHBACTERIOPHEOPHYTIN AL,M1JH00.71
BPHBACTERIOPHEOPHYTIN AH,L,M2GMR0.71
BPHBACTERIOPHEOPHYTIN AH,L,M3DU20.71
BPHBACTERIOPHEOPHYTIN AL,M1PSS0.71
BPHBACTERIOPHEOPHYTIN AH,L,M2HG90.71
BPHBACTERIOPHEOPHYTIN AH,L,M2HIT0.71
BPHBACTERIOPHEOPHYTIN AH,L,M2JIY0.71
BPHBACTERIOPHEOPHYTIN AH,L,M2UWU0.71
BPHBACTERIOPHEOPHYTIN AL,M1JGZ0.71
BPHBACTERIOPHEOPHYTIN AH,L,M2J8C0.71
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DV30.71
BPHBACTERIOPHEOPHYTIN AH,L,M3DSY0.71
BPHBACTERIOPHEOPHYTIN AH,L,M1F6N0.71
BPHBACTERIOPHEOPHYTIN AH,L,M1FNP0.71
BPHBACTERIOPHEOPHYTIN AH,L,M1K6L0.71
BPHBACTERIOPHEOPHYTIN AH,L,M2HHK0.71
BPHBACTERIOPHEOPHYTIN AL,M1JGW0.71
BPHBACTERIOPHEOPHYTIN AH,L,M2J8D0.71
BPHBACTERIOPHEOPHYTIN AL,M1YST0.71
BPHBACTERIOPHEOPHYTIN AH,L,M3DTR0.71
BPHBACTERIOPHEOPHYTIN AL,M1JGY0.71
BPHBACTERIOPHEOPHYTIN AH,L,M2HH10.71
AGE(2E)-N-hydroxy-3-[1-methyl-4-(phenylacetyl)-
1H-pyrrol-2-yl]prop-2-enamide
A,B,C3F070.74
3HI(3R,5R)-7-[2-(4-fluorophenyl)-4-
[(2-hydroxyphenyl)carbamoyl]-5-
(1-methylethyl)-3-phenyl-1H-pyrrol-
1-yl]-3,5-dihydroxyheptanoic acid
B,C,D3CCT0.73
9365-METHOXY-1,2-DIMETHYL-3-(4-NITROPHENOXYMETHYL)INDOLE-
4,7-DIONE
A,B,C,D1KBQ0.7