80 SMILES Strings for Mitogen-activated protein kinase 1/3

Compound Name
SMILES String
CC(C)(C)c1nc2c([nH]1)c1ccc(F)cc1c1c2cc[nH]c1=O
CCN(CC)CC=Cc1[nH]c(=O)c2c3n(C)c(Nc4c(Cl)cccc4Cl)nc3ccc2c1C |w:6.5|
Cc1cccc(Nc2nc(N[C@@H]3CCCC[C@@H]3N)ncc2C(N)=O)c1 |r|
Cc1cccc(Nc2nc(N[C@H]3CCNC3)ncc2C(N)=O)c1 |r|
c1cc(cc(c1)Nc2c(cnc(n2)N3CCC[C@@H](C3)N)C(=O)N)C(F)(F)F
Cc1cccc(Nc2nc(N[C@H]3CCCC[C@H]3N)ncc2C(N)=O)c1 |r|
Cc1cccc(Nc2nc(NC[C@@H]3CCCN3)ncc2C(N)=O)c1 |r|
Cc1cccc(Nc2nc(N[C@@H]3COC[C@@H]3N)ncc2C(N)=O)c1 |r|
Cc1cccc(Nc2nc(N[C@@H]3CCC(F)(F)C[C@@H]3N)ncc2C(N)=O)c1 |r|
Cc1cccc(Nc2nc(N[C@@H]3CCOC[C@@H]3N)ncc2C(N)=O)c1 |r|
Cc1cccc(Nc2nc(N[C@@H]3CCCNC3)ncc2C(N)=O)c1 |r|
Cc1cccc(Nc2nc(N[C@H]3CCCNC3)ncc2C(N)=O)c1 |r|
COc1ccc(Nc2nc(N[C@@H]3CCOC[C@@H]3N)ncc2C(N)=O)cc1 |r|
Cc1ccc(Nc2nc(N[C@@H]3CCCC[C@@H]3N)ncc2C(N)=O)cc1 |r|
Cc1ccc(cc1)Nc2c(cnc(n2)N[C@@H]3CCOC[C@@H]3N)C(=O)N
Cc1cccc(Nc2nc(N[C@@H]3CC(F)(F)CC[C@@H]3N)ncc2C(N)=O)c1 |r|
COc1cc2c(Nc3ccc(Sc4nccn4C)c(Cl)c3)c(cnc2cc1OCCCN1CCOCC1)C#N
CC(C)(C)NC(=O)Nc1nc2nc(N)ncc2cc1-c1c(Cl)cccc1Cl |(4.56,-3.94,;3.23,-3.17,;1.89,-3.94,;3.23,-4.71,;3.23,-1.63,;1.89,-.86,;.56,-1.63,;1.89,.68,;.56,1.45,;-.77,.68,;-2.11,1.45,;-3.44,.68,;-4.78,1.45,;-6.11,.68,;-4.78,2.99,;-3.44,3.76,;-2.11,2.99,;-.77,3.76,;.56,2.99,;1.89,3.76,;1.89,5.3,;.56,6.07,;3.23,6.07,;4.56,5.3,;4.56,3.76,;3.23,2.99,;3.23,1.45,)|
COc1cc(OC)cc(c1)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C
COc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)cc1OC
Cc1cc(C)c(C)c(c1C)-c1cc2cnc(N)nc2nc1NC(=O)NC(C)(C)C |(4.16,7.26,;4.16,5.72,;5.49,4.95,;5.49,3.41,;6.83,2.64,;4.16,2.64,;4.16,1.1,;2.83,3.41,;2.83,4.95,;1.49,5.72,;1.49,2.64,;.16,3.41,;-1.17,2.64,;-2.51,3.41,;-3.84,2.64,;-3.84,1.1,;-5.18,.33,;-2.51,.33,;-1.17,1.1,;.16,.33,;1.49,1.1,;2.83,.33,;2.83,-1.21,;1.49,-1.98,;4.16,-1.98,;4.16,-3.52,;2.67,-3.92,;5.49,-4.29,;4.16,-5.06,)|
COc1cc2c(Nc3ccc(Oc4ccccc4)cc3)c(cnc2cc1OCCCN1CCOCC1)C#N
C[C@@H](N1Cc2ccc(cc2C1=O)-c1nc(NC2CCOCC2)ncc1Cl)C(=O)N[C@H](CO)c1cccc(C)c1 |r|
CN(C(=O)CN1Cc2ccc(cc2C1=O)-c1nc(NC2CCOCC2)ncc1Cl)C(C)(C)C
COC[C@H]1Cn2cc(cc2C(=O)N1Cc1cccc(C)n1)-c1nc(Nc2ccnn2C)ncc1C |r|
Cn1c(ccn1)Nc2nccc(n2)C3=CC(=O)N(C=C3)[C@H](CO)c4ccc(c(c4)F)Cl
C[C@@H]1Cn2cc(cc2C(=O)N1Cc1cccc(C)n1)-c1nc(Nc2ccnn2C)ncc1C |r|
Cc1cnc(Nc2ccnn2C)nc1-c1cc2C(=O)N(Cc3cccc(Cl)c3)CCn2c1
Cc1cnc(Nc2ccnn2C)nc1-c1cn2CCN(Cc3cccc(Cl)c3)C(=O)c2n1
Cc1cnc(Nc2ccnn2C)nc1-c1cn2CCN(Cc3ccc(F)c(F)c3)C(=O)c2n1
Cc1cnc(Nc2ccnn2C)nc1-c1cc2C(=O)N(Cc3ccc(F)c(F)c3)CCn2c1
COC[C@H]1Cn2cc(nc2C(=O)N1Cc1ccc(F)c(F)c1)-c1nc(Nc2ccnn2C)ncc1C |r|
O=C(CN1CC[C@H](C1)C(=O)Nc1ccc2[nH]nc(-c3ccncc3)c2c1)N1CCN(CC1)c1ccc(cc1)-c1ncccn1 |r|
CC(C)Nc1cc(-c2c[nH]c(c2)C(=O)N[C@H](CO)c2cccc(Cl)c2)c(Cl)cn1 |r|
C[C@H]1Cn2cc(nc2C(=O)N1Cc1ccc(F)c(F)c1)-c1nc(Nc2ccnn2C)ncc1C |r|
Cc1cnc(Nc2ccnn2C)nc1-c1cc2CN([C@H](CO)c3cccc(Cl)c3)C(=O)n2c1 |r|
Oc1cc(-c2nc3OCC4C5CCC(CN4c4nc(OC[C@@]67CCCN6C[C@H](F)C7)nc(c2F)c34)N5)c2c(Cl)cccc2c1 |r|
F[C@H]1CN2CCC[C@@]2(COc2nc3N4CC5CCC(N5)C4COc4nc(c(F)c(n2)c34)-c2cccc3ccc(F)c(C#C)c23)C1 |r|
F[C@H]1CN2CCC[C@@]2(COc2nc3N4C[C@H]5CC[C@H](N5)[C@H]4COc4nc(c(F)c(n2)c34)-c2cccc3ccc(F)c(C#C)c23)C1 |r|
Oc1cc(Cl)c(C2CC2)c(c1)-c1nc2OCC3C4CCC(CN3c3nc(OC[C@@]56CCCN5C[C@H](F)C6)nc(c1F)c23)N4 |r|
[H][C@]12CC[C@]([H])(N1)[C@@]1([H])COc3nc(c(F)c4nc(OC[C@@]56CCCN5C[C@H](F)C6)nc(N1C2)c34)-c1cccc2cccc(C#C)c12 |r|
Oc1cc(-c2nc3OC[C@@H]4[C@@H]5CC[C@H](CN4c4nc(OC[C@@]67CCCN6C[C@H](F)C7)nc(c2F)c34)N5)c2c(Cl)cccc2c1 |r|
[H][C@]12CC[C@]([H])(N1)[C@@]1([H])COc3nc(c(F)c4nc(OC[C@@]56CCCN5C[C@H](F)C6)nc(N1C2)c34)-c1cc(O)cc2ccc(F)c(CC)c12 |r|
Oc1cc(-c2ncc3c(nc(OC[C@@]45CCCN4C[C@H](F)C5)nc3c2F)N2CC3CCC(C2)N3)c2c(C#C)c(F)ccc2c1 |r|
CC1(N)CCN(CC1)c1cnc(c(N)n1)-c1cccc(Cl)c1Cl
CC1(N)CCN(CC1)c1cnc2n(ncc2n1)-c1cccc(Cl)c1Cl
CC1(N)CCN(CC1)c1cnc2c(Sc3cccc(Cl)c3Cl)cnn2c1
CC1(N)CCN(CC1)c1ccnc2c(Sc3cccc(Cl)c3Cl)cnn12
CC1(N)CCN(CC1)c1cnc2cc(ccc2n1)-c1cccc(Cl)c1Cl
CC1(N)CCN(CC1)c1ncc(Sc2cccc(Cl)c2Cl)n2nccc12
CC1(CCN(CC1)c2cnc3c(n2)ccc(n3)Sc4cccc(c4Cl)Cl)N
CC1(N)CCN(CC1)c1ccc(Sc2cccc(Cl)c2Cl)n2nccc12
CC1(N)CCN(CC1)c1cnc2nc(ccc2n1)-c1cccc(Cl)c1Cl
CC1(N)CCN(CC1)c1cnc2nc(ccc2n1)-c1cccc(F)c1Cl
CC1(N)CCN(CC1)c1cnc2nc(ccc2n1)-c1cccc2ccccc12
COc1cccc(Sc2ccc3nc(cnc3n2)N2CCC(C)(N)CC2)c1Cl
CC1(N)CCN(CC1)c1cnc2nc(Sc3cccc(C#N)c3Cl)ccc2n1
CC1(N)CCN(CC1)c1cnc2nc(Oc3cccc(Cl)c3Cl)ccc2n1
CC1(N)CCN(CC1)c1cnc2nc(Sc3ccnc(N)c3Cl)ccc2n1
COc1nccc(Sc2ccc3nc(cnc3n2)N2CCC(C)(N)CC2)c1Cl
CC1(N)CCN(CC1)c1cnc2nc(Sc3cccn4nccc34)ccc2n1
CC1(CN)CCN(CC1)c1cnc2nc(Sc3ccnc(N)c3Cl)ccc2n1
CNC1(C)CCN(CC1)c1cnc2nc(Sc3ccnc(N)c3Cl)ccc2n1
N[C@H]1CCCN(CC1)c1cnc2nc(Sc3ccnc(N)c3Cl)ccc2n1 |r|
[H][C@]12CC[C@@]([H])(CC(N)C1)N2c1cnc2nc(Sc3ccnc(N)c3Cl)ccc2n1 |r|
[H][C@]12C[C@]([H])(CN(C1)c1cnc3nc(Sc4ccnc(N)c4Cl)ccc3n1)[C@@H]2N |r|
N[C@@H]1C[C@H](O)CC11CCN(CC1)c1cnc2nc(Sc3ccnc(N)c3Cl)ccc2n1 |r|
C[C@H]1[C@H](C2(CCN(CC2)c3cnc4c(n3)ccc(n4)Sc5ccnc(c5Cl)N)CO1)N
N[C@@H]1c2ccccc2CC11CCN(CC1)c1cnc2nc(Sc3ccnc(N)c3Cl)ccc2n1 |r|
N[C@@H]1c2ccc(F)cc2CC11CCN(CC1)c1cnc2nc(Sc3ccnc(N)c3Cl)ccc2n1 |r|
COc1ccc2CC3(CCN(CC3)c3cnc4nc(Sc5ccnc(N)c5Cl)ccc4n3)[C@H](N)c2c1 |r|
N[C@@H]1c2ccc(Cl)cc2CC11CCN(CC1)c1cnc2nc(Sc3ccnc(N)c3Cl)ccc2n1 |r|
Cc1ccc2CC3(CCN(CC3)c3cnc4nc(Sc5ccnc(N)c5Cl)ccc4n3)[C@H](N)c2c1 |r|
N[C@@H]1c2cccnc2CC11CCN(CC1)c1cnc2nc(Sc3ccnc(N)c3Cl)ccc2n1 |r|
Cc1ccc2[C@@H](N)C3(Cc2n1)CCN(CC3)c1cnc2nc(Sc3ccnc(N)c3Cl)ccc2n1 |r|
N[C@@H]1c2cc(F)cnc2CC11CCN(CC1)c1cnc2nc(Sc3ccnc(N)c3Cl)ccc2n1 |r|
COc1cnc2CC3(CCN(CC3)c3cnc4nc(Sc5ccnc(N)c5Cl)ccc4n3)[C@H](N)c2c1 |r|
COc1cccc(c1N)-c1cc(=O)c2ccccc2o1
COc1cccc(-c2cc(=O)c3ccccc3s2)c1N
C[C@@]1(O)C[C@@H](C1)c1nc(-c2ccc3ccc(nc3c2)-c2ccccc2)c2c(N)nccn12 |r,wU:1.1,4.6,wD:1.0,(18.42,-37.26,;17.1,-36.49,;16.31,-37.82,;17.79,-35.11,;16.41,-34.42,;15.72,-35.8,;15.93,-32.97,;16.83,-31.71,;15.91,-30.47,;16.38,-29.01,;15.35,-27.88,;15.81,-26.41,;17.32,-26.08,;17.78,-24.62,;19.27,-24.29,;20.31,-25.42,;19.85,-26.89,;18.35,-27.21,;17.89,-28.68,;21.81,-25.09,;22.85,-26.23,;24.35,-25.9,;24.82,-24.43,;23.77,-23.29,;22.27,-23.63,;14.45,-30.96,;13.11,-30.19,;13.11,-28.65,;11.78,-30.96,;11.78,-32.51,;13.12,-33.28,;14.46,-32.5,)|