SMILES for Serine/threonine-protein kinase/endoribonuclease IRE1 [547-977]

47 SMILES Strings for Serine/threonine-protein kinase/endoribonuclease IRE1 [547-977]

Compound Name

SMILES String

BDBM192719

CC(C)c1nc(-c2ccc(NC(=O)Nc3cccc(c3)C(F)(F)F)c3ccccc23)c2c(N)nccn12

BDBM192720

CC(C)(C)c1nc(-c2ccc(NC(=O)Nc3cccc(c3)C(F)(F)F)c3ccccc23)c2c(N)nccn12

BDBM192721

CC1(CC1)c1nc(-c2ccc(NC(=O)Nc3cccc(c3)C(F)(F)F)c3ccccc23)c2c(N)nccn12

BDBM192722

Nc1nccn2c(nc(-c3ccc(NC(=O)Nc4cccc(c4)C(F)(F)F)c4ccccc34)c12)C1CCC1

BDBM192723

Nc1nccn2c(nc(-c3ccc(NC(=O)Nc4cccc(c4)C(F)(F)F)c4ccccc34)c12)C1CC1

BDBM192724

CC1(COC1)c1nc(-c2ccc(NC(=O)Nc3cccc(c3)C(F)(F)F)c3ccccc23)c2c(N)nccn12

BDBM192725

CC1(CC1)c1nc(-c2ccc(NC(=O)Nc3cccc(c3)C(F)(F)F)cc2F)c2c(N)nccn12

BDBM60931

Cc1cc(NC(=O)Nc2cccc(c2)C(F)(F)F)ccc1-c1nc(n2ccnc(N)c12)C1(C)CC1

BDBM192727

CC1(CC1)c1nc(-c2ccc(NC(=O)Nc3cccc(c3)C(F)(F)F)cc2Cl)c2c(N)nccn12

BDBM192728

Cc1c(C)c(ccc1NC(=O)Nc1cccc(c1)C(F)(F)F)-c1nc(n2ccnc(N)c12)C1(C)CC1

BDBM192729

CC1(CC1)c1nc(-c2ccc(NC(=O)Nc3cccc(c3)C(F)(F)F)c(F)c2F)c2c(N)nccn12

BDBM192730

CC1(CC1)c1nc(-c2ccc(NC(=O)Nc3ccccc3)c3ccccc23)c2c(N)nccn12

BDBM192731

CC1(CC1)c1nc(-c2ccc(NC(=O)Nc3cccc(F)c3)c3ccccc23)c2c(N)nccn12

BDBM192732

Cc1cccc(NC(=O)Nc2ccc(-c3nc(n4ccnc(N)c34)C3(C)CC3)c3ccccc23)c1

BDBM192733

COc1cccc(NC(=O)Nc2ccc(-c3nc(n4ccnc(N)c34)C3(C)CC3)c3ccccc23)c1

BDBM192734

CSc1cccc(NC(=O)Nc2ccc(-c3nc(n4ccnc(N)c34)C3(C)CC3)c3ccccc23)c1

BDBM192735

COc1cc(NC(=O)Nc2ccc(-c3nc(n4ccnc(N)c34)C3(C)CC3)c3ccccc23)cc(c1)C(F)(F)F

BDBM192736

CC1(CC1)c1nc(-c2ccc(NC(=O)Nc3cc(F)cc(c3)C(F)(F)F)c3ccccc23)c2c(N)nccn12

BDBM192737

CNS(=O)(=O)c1cccc(NC(=O)Nc2ccc(-c3nc(n4ccnc(N)c34)C3(C)CC3)c3ccccc23)c1

BDBM192738

CN1CCN(Cc2ccc(NC(=O)Nc3ccc(-c4nc(n5ccnc(N)c45)C4(C)CC4)c4ccccc34)cc2C(F)(F)F)CC1

BDBM192739

CN1CCN(Cc2ccc(NC(=O)Nc3ccc(-c4nc(n5ccnc(N)c45)C4(C)CC4)c4ccccc34)cc2)CC1

BDBM192740

Cc1cc(NC(=O)Nc2ccc(-c3nc(n4ccnc(N)c34)C3(C)CC3)c3ccccc23)n[nH]1

BDBM192741

CC1(CC1)c1nc(-c2ccc(NC(=O)NCc3ccccc3)c3ccccc23)c2c(N)nccn12

BDBM192742

CC1(CC1)c1nc(-c2ccc(NC(=O)NCCc3ccccc3)c3ccccc23)c2c(N)nccn12

BDBM192743

CC1(CC1)c1nc(-c2ccc(NC(=O)NC3CCCCC3)c3ccccc23)c2c(N)nccn12

BDBM192744

CC1(CC1)c1nc(-c2ccc(NC(=O)N3CCOCC3)c3ccccc23)c2c(N)nccn12

BDBM192745

CC1(CC1)c1nc(-c2ccc(NC(=O)N3CCCCC3)c3ccccc23)c2c(N)nccn12

BDBM192746

CC1(CC1)c1nc(-c2ccc(NC(=O)NC3CC3)c3ccccc23)c2c(N)nccn12

BDBM192747

CN(C(=O)Nc1ccc(-c2nc(n3ccnc(N)c23)C2(C)CC2)c2ccccc12)c1cccc(c1)C(F)(F)F

BDBM192748

CC(C)(C)c1nc(-c2ccc(NC(=O)N3CCN(C3=O)c3cccc(c3)C(F)(F)F)c3ccccc23)c2c(N)nccn12

BDBM192749

CC1(CC1)c1nc(-c2ccc(NC(=O)OCCc3ccccc3)c3ccccc23)c2c(N)nccn12

BDBM192750

CC1(CC1)c1nc(-c2ccc(NC(=O)OCC(=O)c3ccccc3)c3ccccc23)c2c(N)nccn12

BDBM482158

CC(C)S(=O)(=O)c1ccccc1Nc2c(cnc(n2)Nc3ccc(cc3OC)N4CCC(CC4)N5CCN(CC5)C)Cl

BDBM50062357

CN(C)C1CCN(CC1)c2ccc(c(c2)OC)Nc3ncc(c(n3)Nc4ccccc4P(=O)(C)C)Cl

BDBM192751

O=C(NC1CC1)Nc1cc(n[nH]1)-c1nc2ccc(CN3CCOCC3)cc2[nH]1

BDBM50389803

c1cc(cc(c1)F)c2cc(c(s2)C(=O)N[C@H]3CCCNC3)NC(=O)N

BDBM192752

COc1cc(ccc1Nc1ncc(Cl)c(n1)-c1c[nH]c2ccccc12)N1CCC(N)CC1

BDBM16018

O=C1c2ccccc2-c2n[nH]c3cccc1c23

BDBM192753

CCS(=O)(=O)Nc1ccc2c(c1)/C(=C(\c3ccccc3)/Nc4ccc(cc4)CN5CCCCC5)/C(=O)N2

BDBM185149

CC1(COc2ccc3n(cnc3c2)-c2ccc3cccc(N4CCC(N)CC4)c3n2)COC1

BDBM50334594

CNC(=O)c1ccccc1Nc2c(cnc(n2)Nc3ccc(cc3OC)N4CCOCC4)Cl

BDBM192754

N[C@H]1CCCCC1Nc1ncc(C(N)=O)c(Nc2cccc(c2)-n2nccn2)n1 |r|

BDBM50130725

Oc1ccc(NC2=C(C(=O)NC2=O)c2ccccc2[N+]([O-])=O)cc1Cl |t:6|

BDBM50175688

c1ccc2c(c1)cc(s2)c3ccnc(n3)Nc4ccc(cc4)C(=O)N5CCC(CC5)N6CCCC6

BDBM25919

Cc1cnc2c(NCCN)nc3ccc(C)cc3n12

BDBM192755

Cc1cnc(nc1Nc2cccc(c2)S(=O)(=O)NC(C)(C)C)Nc3ccc(cc3)N4CCN(CC4)C

BDBM50436850

Cc1cc(c(cc1C2CCNCC2)OC(C)C)Nc3ncc(c(n3)Nc4ccccc4S(=O)(=O)C(C)C)Cl