表观遗传阅读器结构域 - 表观遗传学 - 按“信号通路”分类 - 小分子和化合物库

(+/-)-JQ1,Brd4 抑制剂

规格或纯度 :

≥98%(HPLC)

CAS号: 1268524-69-1

分子式: C₂₃H₂₅ClN₄O₂S 分子量: 456.99

IUPAC Name: tert-butyl 2-[7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]acetate

SMILES: CC1=C(SC2=C1C(=NC(C3=NN=C(N32)C)CC(=O)OC(C)(C)C)C4=CC=C(C=C4)Cl)C

InChIKey: DNVXATUJJDPFDM-UHFFFAOYSA-N

InChI: 1S/C23H25ClN4O2S/c1-12-13(2)31-22-19(12)20(15-7-9-16(24)10-8-15)25-17(11-18(29)30-23(4,5)6)21-27-26-14(3)28(21)22/h7-10,17H,11H2,1-6H3

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(+)-JQ1,BET溴结构域抑制剂

规格或纯度 :

≥98%(HPLC)

CAS号: 1268524-70-4

分子式: C₂₃H₂₅ClN₄O₂S 分子量: 456.99

IUPAC Name: tert-butyl 2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]acetate

SMILES: CC1=C(SC2=C1C(=NC(C3=NN=C(N32)C)CC(=O)OC(C)(C)C)C4=CC=C(C=C4)Cl)C

InChIKey: DNVXATUJJDPFDM-KRWDZBQOSA-N

InChI: 1S/C23H25ClN4O2S/c1-12-13(2)31-22-19(12)20(15-7-9-16(24)10-8-15)25-17(11-18(29)30-23(4,5)6)21-27-26-14(3)28(21)22/h7-10,17H,11H2,1-6H3/t17-/m0/s1

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I-BET762,的BRD抑制剂

规格或纯度 :

Moligand™

≥98%(HPLC)

CAS号: 1260907-17-2

分子式: C₂₂H₂₂ClN₅O₂ 分子量: 423.9

IUPAC Name: 2-[(4S)-6-(4-chlorophenyl)-8-methoxy-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-4-yl]-N-ethylacetamide

SMILES: CCNC(=O)CC1C2=NN=C(N2C3=C(C=C(C=C3)OC)C(=N1)C4=CC=C(C=C4)Cl)C

InChIKey: AAAQFGUYHFJNHI-SFHVURJKSA-N

InChI: 1S/C22H22ClN5O2/c1-4-24-20(29)12-18-22-27-26-13(2)28(22)19-10-9-16(30-3)11-17(19)21(25-18)14-5-7-15(23)8-6-14/h5-11,18H,4,12H2,1-3H3,(H,24,29)/t18-/m0/s1

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CPI203,BET溴结构域抑制剂

规格或纯度 :

Moligand™

≥98%(HPLC)

CAS号: 1446144-04-2

分子式: C₁₉H₁₈ClN₅OS 分子量: 399.9

IUPAC Name: 2-[(9S)-7-(4-chlorophenyl)-4,5,13-trimethyl-3-thia-1,8,11,12-tetrazatricyclo[8.3.0.02,6]trideca-2(6),4,7,10,12-pentaen-9-yl]acetamide

SMILES: CC1=C(SC2=C1C(=NC(C3=NN=C(N32)C)CC(=O)N)C4=CC=C(C=C4)Cl)C

InChIKey: QECMENZMDBOLDR-AWEZNQCLSA-N

InChI: 1S/C19H18ClN5OS/c1-9-10(2)27-19-16(9)17(12-4-6-13(20)7-5-12)22-14(8-15(21)26)18-24-23-11(3)25(18)19/h4-7,14H,8H2,1-3H3,(H2,21,26)/t14-/m0/s1

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TC AC 28,BET溴结构域配体

规格或纯度 :

≥98%(HPLC)

CAS号: 1809296-92-1 Compound CID : 118121364

分子式: C₂₃H₂₁N₅O₃ 分子量: 415.44

IUPAC Name: methyl 2-[6-(1H-indol-4-yl)-8-methoxy-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-4-yl]acetate

SMILES: CC1=NN=C2N1C3=C(C=C(C=C3)OC)C(=NC2CC(=O)OC)C4=C5C=CNC5=CC=C4

InChIKey: RARZHTSXOQRRPR-UHFFFAOYSA-N

InChI: 1S/C23H21N5O3/c1-13-26-27-23-19(12-21(29)31-3)25-22(16-5-4-6-18-15(16)9-10-24-18)17-11-14(30-2)7-8-20(17)28(13)23/h4-11,19,24H,12H2,1-3H3

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PF CBP1,CBP / p300溴结构域抑制剂

规格或纯度 :

≥98%(HPLC)

CAS号: 1962928-21-7 Compound CID : 119081417

分子式: C₂₉H₃₆N₄O₃ 分子量: 488.62

IUPAC Name: 4-[2-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[2-(4-propoxyphenyl)ethyl]benzimidazol-1-yl]ethyl]morpholine

SMILES: CCCOC1=CC=C(C=C1)CCC2=NC3=C(N2CCN4CCOCC4)C=CC(=C3)C5=C(ON=C5C)C

InChIKey: CGWBJJZOKGZCSJ-UHFFFAOYSA-N

InChI: 1S/C29H36N4O3/c1-4-17-35-25-9-5-23(6-10-25)7-12-28-30-26-20-24(29-21(2)31-36-22(29)3)8-11-27(26)33(28)14-13-32-15-18-34-19-16-32/h5-6,8-11,20H,4,7,12-19H2,1-3H3

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OXF BD 02,BRD4（1）抑制剂

规格或纯度 :

≥98%(HPLC)

CAS号: 1429129-68-9

分子式: C₁₈H₁₇NO₃ 分子量: 295.33

IUPAC Name: 3-(3,5-dimethyl-1,2-oxazol-4-yl)-5-[hydroxy(phenyl)methyl]phenol

SMILES: CC1=C(C(=NO1)C)C2=CC(=CC(=C2)O)C(C3=CC=CC=C3)O

InChIKey: FEQUIPXIENTMJN-UHFFFAOYSA-N

InChI: 1S/C18H17NO3/c1-11-17(12(2)22-19-11)14-8-15(10-16(20)9-14)18(21)13-6-4-3-5-7-13/h3-10,18,20-21H,1-2H3

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OF 1,BRPF1B和BRPF2抑制剂

规格或纯度 :

Moligand™

≥98%(HPLC)

CAS号: 919973-83-4 EC号: 809-510-5

分子式: C₁₇H₁₈BrN₃O₄S 分子量: 440.31

IUPAC Name: 4-bromo-N-(6-methoxy-1,3-dimethyl-2-oxobenzimidazol-5-yl)-2-methylbenzenesulfonamide

SMILES: CC1=C(C=CC(=C1)Br)S(=O)(=O)NC2=CC3=C(C=C2OC)N(C(=O)N3C)C

InChIKey: YUNQZQREIHWDQT-UHFFFAOYSA-N

InChI: 1S/C17H18BrN3O4S/c1-10-7-11(18)5-6-16(10)26(23,24)19-12-8-13-14(9-15(12)25-4)21(3)17(22)20(13)2/h5-9,19H,1-4H3

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NVS-CECR2-1,CECR2抑制剂

规格或纯度 :

Moligand™

≥98%(HPLC)

CAS号: 1992047-61-6

分子式: C₂₇H₃₇N₅O₂S 分子量: 495.68

IUPAC Name: N-cyclopropyl-2-propylsulfonyl-6-[1-(2,2,6,6-tetramethylpiperidin-4-yl)indol-5-yl]pyrimidin-4-amine

SMILES: CCCS(=O)(=O)C1=NC(=CC(=N1)NC2CC2)C3=CC4=C(C=C3)N(C=C4)C5CC(NC(C5)(C)C)(C)C

InChIKey: XVECNLUKQDKOST-UHFFFAOYSA-N

InChI: 1S/C27H37N5O2S/c1-6-13-35(33,34)25-29-22(15-24(30-25)28-20-8-9-20)18-7-10-23-19(14-18)11-12-32(23)21-16-26(2,3)31-27(4,5)17-21/h7,10-12,14-15,20-21,31H,6,8-9,13,16-17H2,1-5H3,(H,28,29,30)

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LP 99,BRD7和BRD9抑制剂

规格或纯度 :

Moligand™

≥98%(HPLC)

CAS号: 1808951-93-0 Compound CID : 91827372

分子式: C₂₆H₃₀ClN₃O₄S 分子量: 516.05

IUPAC Name: N-[(2R,3S)-2-(4-chlorophenyl)-1-(1,4-dimethyl-2-oxoquinolin-7-yl)-6-oxopiperidin-3-yl]-2-methylpropane-1-sulfonamide

SMILES: CC1=CC(=O)N(C2=C1C=CC(=C2)N3C(C(CCC3=O)NS(=O)(=O)CC(C)C)C4=CC=C(C=C4)Cl)C

InChIKey: LVDRREOUMKACNJ-BKMJKUGQSA-N

InChI: 1S/C26H30ClN3O4S/c1-16(2)15-35(33,34)28-22-11-12-24(31)30(26(22)18-5-7-19(27)8-6-18)20-9-10-21-17(3)13-25(32)29(4)23(21)14-20/h5-10,13-14,16,22,26,28H,11-12,15H2,1-4H3/t22-,26+/m0/s1

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ISOX DUAL,双重BRD4和CBP / p300溴结构域抑制剂

规格或纯度 :

≥98%(HPLC)

CAS号: 1962928-22-8

分子式: C₃₁H₄₁N₅O₃ 分子量: 531.69

IUPAC Name: 3-[4-[2-[5-(3,5-dimethyl-1,2-oxazol-4-yl)-1-(2-morpholin-4-ylethyl)benzimidazol-2-yl]ethyl]phenoxy]-N,N-dimethylpropan-1-amine

SMILES: CC1=C(C(=NO1)C)C2=CC3=C(C=C2)N(C(=N3)CCC4=CC=C(C=C4)OCCCN(C)C)CCN5CCOCC5

InChIKey: HCDQWCDANVEBQR-UHFFFAOYSA-N

InChI: 1S/C31H41N5O3/c1-23-31(24(2)39-33-23)26-9-12-29-28(22-26)32-30(36(29)16-15-35-17-20-37-21-18-35)13-8-25-6-10-27(11-7-25)38-19-5-14-34(3)4/h6-7,9-12,22H,5,8,13-21H2,1-4H3

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I-CBP 112,CBP / p300 BRD抑制剂

规格或纯度 :

Moligand™

≥98%(HPLC)

CAS号: 1640282-31-0

分子式: C₂₇H₃₆N₂O₅ 分子量: 468.59

IUPAC Name: 1-[7-(3,4-dimethoxyphenyl)-9-[[(3S)-1-methylpiperidin-3-yl]methoxy]-3,5-dihydro-2H-1,4-benzoxazepin-4-yl]propan-1-one

SMILES: CCC(=O)N1CCOC2=C(C1)C=C(C=C2OCC3CCCN(C3)C)C4=CC(=C(C=C4)OC)OC

InChIKey: YKNAKDFZAWQEEO-IBGZPJMESA-N

InChI: 1S/C27H36N2O5/c1-5-26(30)29-11-12-33-27-22(17-29)13-21(20-8-9-23(31-3)24(14-20)32-4)15-25(27)34-18-19-7-6-10-28(2)16-19/h8-9,13-15,19H,5-7,10-12,16-18H2,1-4H3/t19-/m0/s1

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