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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00984002

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
BH1BACTERIOPHEOPHYTINH,L,M2BOZ0.72
BH1BACTERIOPHEOPHYTINA,B2BNS0.72
BH1BACTERIOPHEOPHYTINA,B2BNP0.72
BPHBACTERIOPHEOPHYTIN AH,L,M1RG50.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UWT0.74
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
1PYH0.74
BPHBACTERIOPHEOPHYTIN AA,B,C1Z9K0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UXK0.74
BPHBACTERIOPHEOPHYTIN AH,L,M1RY50.74
BPHBACTERIOPHEOPHYTIN AH,L,M1RZH0.74
BPHBACTERIOPHEOPHYTIN AC,H,L,M1EYS0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UWS0.74
BPHBACTERIOPHEOPHYTIN AL,M4RCR0.74
BPHBACTERIOPHEOPHYTIN AH,L,M1K6N0.74
BPHBACTERIOPHEOPHYTIN AL,M1YF60.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UX50.74
BPHBACTERIOPHEOPHYTIN AH,L,M3DTS0.74
BPHBACTERIOPHEOPHYTIN AC1E140.74
BPHBACTERIOPHEOPHYTIN AH,L,M3DTA0.74
BPHBACTERIOPHEOPHYTIN AL,M1PST0.74
BPHBACTERIOPHEOPHYTIN AL,M1KBY0.74
BPHBACTERIOPHEOPHYTIN AC,H,L,M1L9B0.74
BPHBACTERIOPHEOPHYTIN AL,M2RCR0.74
BPHBACTERIOPHEOPHYTIN AL,M1PCR0.74
BPHBACTERIOPHEOPHYTIN AL,M1M3X0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2HJ60.74
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DS80.74
BPHBACTERIOPHEOPHYTIN AH,L,M1FNQ0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UXJ0.74
BPHBACTERIOPHEOPHYTIN AL,M1QOV0.74
BPHBACTERIOPHEOPHYTIN AH,L,M3DU30.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UX40.74
BPHBACTERIOPHEOPHYTIN AL,M,R,S1AIJ0.74
BPHBACTERIOPHEOPHYTIN AL,M,N,O1AIG0.74
BPHBACTERIOPHEOPHYTIN AH,L,M1RGN0.74
BPHBACTERIOPHEOPHYTIN AL,M1JGX0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UWV0.74
BPHBACTERIOPHEOPHYTIN AH,L,M1RQK0.74
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DV60.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UWW0.74
BPHBACTERIOPHEOPHYTIN AL,M,R,S1RZZ0.74
BPHBACTERIOPHEOPHYTIN AL,M,R,S1S000.74
BPHBACTERIOPHEOPHYTIN AH,L,M2HG30.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UX30.74
BPHBACTERIOPHEOPHYTIN AL,M1OGV0.74
BPHBACTERIOPHEOPHYTIN AH,L,M3DUQ0.74
BPHBACTERIOPHEOPHYTIN AA,B1Z9J0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2GNU0.74
BPHBACTERIOPHEOPHYTIN AC1E6D0.74
BPHBACTERIOPHEOPHYTIN AL,M1MPS0.74
BPHBACTERIOPHEOPHYTIN AL,M,X2UXM0.74
BPHBACTERIOPHEOPHYTIN AH,L,M1RVJ0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UXL0.74
BPHBACTERIOPHEOPHYTIN AC,D,L,M,R,S1L9J0.74
BPHBACTERIOPHEOPHYTIN AL,M2JJ00.74
BPHBACTERIOPHEOPHYTIN AL,M1JH00.74
BPHBACTERIOPHEOPHYTIN AH,L,M2GMR0.74
BPHBACTERIOPHEOPHYTIN AH,L,M3DU20.74
BPHBACTERIOPHEOPHYTIN AL,M1PSS0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2HG90.74
BPHBACTERIOPHEOPHYTIN AH,L,M2HIT0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2JIY0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2UWU0.74
BPHBACTERIOPHEOPHYTIN AL,M1JGZ0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2J8C0.74
BPHBACTERIOPHEOPHYTIN AH,L,M,R,S,T1DV30.74
BPHBACTERIOPHEOPHYTIN AH,L,M3DSY0.74
BPHBACTERIOPHEOPHYTIN AH,L,M1F6N0.74
BPHBACTERIOPHEOPHYTIN AH,L,M1FNP0.74
BPHBACTERIOPHEOPHYTIN AH,L,M1K6L0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2HHK0.74
BPHBACTERIOPHEOPHYTIN AL,M1JGW0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2J8D0.74
BPHBACTERIOPHEOPHYTIN AL,M1YST0.74
BPHBACTERIOPHEOPHYTIN AH,L,M3DTR0.74
BPHBACTERIOPHEOPHYTIN AL,M1JGY0.74
BPHBACTERIOPHEOPHYTIN AH,L,M2HH10.74
CRR3,4-DI-1H-INDOL-3-YL-1H-PYRROLE-
2,5-DICARBOXYLIC ACID
A2Z3U0.71
BPBBACTERIOPHEOPHYTIN BC,H,L,M3PRC0.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M6PRC0.74
BPBBACTERIOPHEOPHYTIN BH,L,M1RY50.74
BPBBACTERIOPHEOPHYTIN BH,L,M1RZH0.74
BPBBACTERIOPHEOPHYTIN BL,M,R,S1RZZ0.74
BPBBACTERIOPHEOPHYTIN BL,M,R,S1S000.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M2JBL0.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M1VRN0.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M7PRC0.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M2PRC0.74
BPBBACTERIOPHEOPHYTIN BH,L,M1UMX0.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M1R2C0.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M3D380.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M2I5N0.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M5PRC0.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M1PRC0.74
BPBBACTERIOPHEOPHYTIN BH,L,M1RVJ0.74
BPBBACTERIOPHEOPHYTIN BC,H,L,M,U1DXR0.74
FIC5-fluoroindole-2-carboxylic acidA,B3DWS0.77
5Z55-[(Z)-(5-CHLORO-2-OXO-1,2-DIHYDRO-
3H-INDOL-3-YLIDENE)METHYL]-N-(DIETHYLAMINO)ETHYL]-
2,4-DIMETHYL-1H-PYRROLE-3-CARBOXAMIDE
A2JAV0.7
IDA(2-CARBAMOYLMETHYL-5-PROPYL-OCTAHYDRO-
INDOL-7-YL)ACETIC ACID
A,B1OXL0.71
5DE1-(4-AMINOPHENYL)-3,5-DIMETHYL-
1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYL ESTER
A,B1Y2E0.72
225FELODIPINEA2NNJ0.72
CLI3-(2-CARBOXY-ETHYL)-4,6-DICHLORO-
1H-INDOLE-2-CARBOXYLIC ACID
A,F1LEV0.73
ICO1H-INDOLE-3-CARBOXYLIC ACIDL2PIP0.7
RXB(1S)-2-oxo-1-phenyl-2-[(1,3,4-trioxo-
1,2,3,4-tetrahydroisoquinolin-5-
yl)amino]ethyl acetate
A,B,C,D3DEI0.7
OAI6-(OXALYL-AMINO)-1H-INDOLE-5-CARBOXYLIC ACIDA1C830.74
BIN2,3-DICARBOXY-4-(2-CHLORO-PHENYL)-
1-ETHYL-5-ISOPROPOXYCARBONYL-6-
METHYL-PYRIDINIUM
A1C8L0.71
BIN2,3-DICARBOXY-4-(2-CHLORO-PHENYL)-
1-ETHYL-5-ISOPROPOXYCARBONYL-6-
METHYL-PYRIDINIUM
A2AMV0.71
BIN2,3-DICARBOXY-4-(2-CHLORO-PHENYL)-
1-ETHYL-5-ISOPROPOXYCARBONYL-6-
METHYL-PYRIDINIUM
A3AMV0.71
SNX2-[(2-methoxyethyl)amino]-4-(4-
oxo-1,2,3,4-tetrahydro-9H-carbazol-
9-yl)benzamide
A3D0B0.71
VX32,3-diphenyl-1H-indole-7-carboxylic acidA3BGZ0.7
SU13-[(3-(2-CARBOXYETHYL)-4-METHYLPYRROL-
2-YL)METHYLENE]-2-INDOLINONE
A,B1FGI0.73
A465-chloro-N-{4-[(1R)-1,2-dihydroxyethyl]phenyl}-
1H-indole-2-carboxamide
A,B2ZB20.71
C80(2S,4S,5R,7R)-4-AMINO-8-(BUTYLAMINO)-
5-HYDROXY-2,7-DIMETHYL-8-OXOOCTYL 1-
BENZYL-1H-INDOLE-3-CARBOXYLATE
C,O2V110.72
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,D3CD50.71
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,B3G0F0.71
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
A3G0E0.71
DSI4-HYDROXY-6-(1H-INDOLE-2-CARBONYL)-
8-METHYL-3,6,7,8-TETRAHYDRO-3,6-
DIAZA-AS-INDACENE-2-CARBOXYLIC ACID METHYL ESTER
B1DSI0.7
ONO2-[2-({[4-(DIAMINOMETHYL)PHENYL]AMINO}CARBONYL)-
6-METHOXYPYRIDIN-3-YL]-5-{[(1-FORMYL-
2,2-DIMETHYLPROPYL)AMINO]CARBONYL}BENZOIC ACID
A2AYW0.71
3405-METHOXY-1,2-DIMETHYL-3-(PHENOXYMETHYL)INDOLE-
4,7-DIONE
A,B,C,D1KBO0.71
5702-(2-BENZOYL-PHENYLAMINO)-3-{4-
[2-(5-METHYL-2-PHENYL-OXAZOL-4-
YL)-ETHOXY]-PHENYL}-PROPIONIC ACID
A,D1RDT0.7
5702-(2-BENZOYL-PHENYLAMINO)-3-{4-
[2-(5-METHYL-2-PHENYL-OXAZOL-4-
YL)-ETHOXY]-PHENYL}-PROPIONIC ACID
A,D1FM90.7
3DE3,5-DIMETHYL-1-PHENYL-1H-PYRAZOLE-
4-CARBOXYLIC ACID ETHYL ESTER
A,B1Y2C0.73
CBB1-(3-CARBAMIMIDOYL-BENZYL)-1H-INDOLE-
2-CARBOXYLIC ACID 3-CARBAMIMIDOYL-
BENZYLESTER
B1LPK0.77
PHOPHEOPHYTIN AA,B,C,D,F,H,
K,L,T,V,Z
3A0H0.74
PHOPHEOPHYTIN AZ1W5C0.74
PHOPHEOPHYTIN AA,B,C,D,F,H,
I,K,L,M,T,V,X
2AXT0.74
PHOPHEOPHYTIN AA,B,C,D,E,H,
J,K,L,T,V,Z
3A0B0.74
PHOPHEOPHYTIN AA,B,C,D,E,F,
H,I,J,K,M,O,
T,V,Z
3BZ10.74
PHOPHEOPHYTIN A0,A,B,C,D,E,
G,J,K,L,M,N,
P,R,V,W
1IZL0.74
PHOPHEOPHYTIN AA,B,C,D,E,F,
J,K,V
1S5L0.74
PHOPHEOPHYTIN AA,B,C,D,F,G,
H,I,J,K,L,M,
O,P,Q,R
1ILX0.74
PHOPHEOPHYTIN AA,B,C,D,F,G,
H,I,J,K,L,M,
O,P,Q,R
1FE10.74
PHOPHEOPHYTIN AA,B,C,D,E,F,
H,I,J,K,L,M,
O,T,V,X,Z
3BZ20.74
1IQ2-(4-ISOPROPYL-4-METHYL-5-OXO-4,5-
DIHYDRO-1H-IMIDAZOL-2-YL)QUINOLINE-
3-CARBOXYLIC ACID
A1Z8N0.72
T19PHENYLMETHYLENECARBOXY-(METHYLENEAMINO-
FORMYL-DIPHENYLMETHYL)METHY-PRO-
BOROVAL
H,I1AIX0.72
PQQPYRROLOQUINOLINE QUINONEA,B1CQ10.76
PQQPYRROLOQUINOLINE QUINONEA,B1OTW0.76
PQQPYRROLOQUINOLINE QUINONEA,B1C9U0.76
PQQPYRROLOQUINOLINE QUINONEA,C1W6S0.76
PQQPYRROLOQUINOLINE QUINONEA,B1FLG0.76
PQQPYRROLOQUINOLINE QUINONEA1KV90.76
PQQPYRROLOQUINOLINE QUINONEA,C2AD60.76
PQQPYRROLOQUINOLINE QUINONEA,B1CRU0.76
PQQPYRROLOQUINOLINE QUINONEA,C1H4I0.76
PQQPYRROLOQUINOLINE QUINONEA,C2AD70.76
PQQPYRROLOQUINOLINE QUINONEA,C2AD80.76
PQQPYRROLOQUINOLINE QUINONEA,D,I2D0V0.76
PQQPYRROLOQUINOLINE QUINONEA,C4AAH0.76
PQQPYRROLOQUINOLINE QUINONEA,C,E,G1H4J0.76
PQQPYRROLOQUINOLINE QUINONEA1KB00.76
PQQPYRROLOQUINOLINE QUINONEA1YIQ0.76
PQQPYRROLOQUINOLINE QUINONEA,C1LRW0.76
PQQPYRROLOQUINOLINE QUINONEA,C1G720.76