NO PAINS 化合物库

NO PAINS Compound Library

产品编号： L4020

高通量筛选是药物研发中是一个重要的研究手段，可以通过快速测试大量化合物来发现靶标化合物，真正的药物能够精确作用于特定蛋白质的结合位点，从而抑制或激活蛋白质的功能，然而在高通量筛选实验中发现一些化合物并不是基于化合物与蛋白质之间特异性的作用并且在不同类型靶点筛选中均表现出“活性”的假阳性结果，这类化合物称为泛筛选干扰化合物（PAINS, Pan-assay interference compounds）。PAINS 化合物包括毒黄素、异噻唑酮、绕丹宁、烯酮类等。由于PAINS 的难成药性，给科学家带来了巨大的困扰，浪费了大量的人力和物力资源。

TargetMol NO PAINS 化合物库包含 9384 个剔除了PAINS 的小分子活性化合物，可用于新药研发，信号通路研究，老药新用等研究。

陶术生物的所有产品和服务仅用于科学研究，我们不为任何个人用途提供产品和服务。

产品规格

技术资料

陶术生物化合物库目录(2.8MB)

库化合物信息

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产品描述

-9384个剔除PAINS的化合物小分子活性化合物，可用于高通量筛选和高内涵筛选； -靶点多样，覆盖度广；涵盖多个疾病研究领域，如癌症、代谢、免疫和心血管系统等； -是老药新用、细胞诱导靶点筛选的有效工具； -详细的说明书，化合物结构、靶点信息、活性描述等； -结构多样，药效显著，可渗透细胞； -NMR、HPLC/ LCMS多重检测，保证产品结构准确，纯度高，保障实验顺利进行。

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化合物库组成

Apoptosis (860)

Autophagy (693)

Antibacterial (676)

Endogenous Metabolite (610)

Antibiotic (455)

5-HT Receptor (228)

Parasite (206)

AChR (205)

Antifungal (199)

COX (192)

NF-κB (181)

Adrenergic Receptor (158)

DNA/RNA Synthesis (155)

Potassium Channel (150)

HIV Protease (149)

Dopamine Receptor (144)

Calcium Channel (143)

CDK (139)

PI3K (135)

VEGFR (122)

Reactive Oxygen Species (121)

P450 (114)

EGFR (111)

Histamine Receptor (109)

Sodium Channel (107)

Epigenetic Reader Domain (102)

Influenza Virus (100)

GABA Receptor (100)

Dehydrogenase (97)

JAK (93)

PDE (90)

HDAC (88)

Histone Methyltransferase (84)

PPAR (83)

Estrogen/progestogen Receptor (81)

TRP/TRPV Channel (80)

Ferroptosis (78)

GluR (78)

Microtubule Associated (77)

p38 MAPK (72)

FLT (72)

Antioxidant (71)

AChE (71)

mTOR (70)

TNF (70)

Estrogen Receptor/ERR (69)

ERK (69)

PDGFR (69)

Src (68)

Opioid Receptor (66)

Phosphatase (65)

FGFR (65)

RAAS (64)

Akt (63)

PARP (62)

GPR (62)

iGluR (61)

AMPK (61)

Topoisomerase (60)

SARS-CoV (60)

c-Kit (59)

Caspase (58)

PKC (58)

STAT (57)

Proteasome (56)

HCV Protease (56)

Raf (56)

Prostaglandin Receptor (56)

c-Met/HGFR (55)

Adenosine Receptor (55)

Wnt/beta-catenin (55)

Glucocorticoid Receptor (55)

Virus Protease (54)

IL Receptor (53)

MMP (51)

ATPase (50)

NO Synthase (48)

Mitophagy (47)

Bcr-Abl (47)

NMDAR (47)

TGF-beta/Smad (47)

GSK-3 (46)

ALK (46)

Androgen Receptor (45)

Beta Amyloid (45)

BCL (44)

HSV (44)

HBV (42)

Mitochondrial Metabolism (42)

Nucleoside Antimetabolite/Analog (41)

HSP (40)

TLR (40)

Anti-infection (40)

Tyrosinase (40)

MEK (39)

Aurora Kinase (38)

Sirtuin (38)

HIF/HIF Prolyl-Hydroxylase (38)

JNK (37)

MAO (37)

Drug Metabolite (36)

Phospholipase (36)

ROS (35)

Interleukin (35)

Reverse Transcriptase (35)

Ras (35)

PKA (34)

P-gp (34)

DNA-PK (33)

MAPK (33)

IκB/IKK (33)

Cannabinoid Receptor (33)

Monoamine Oxidase (33)

Integrin (32)

Tyrosine Kinases (32)

Serine/threonin kinase (32)

ROCK (32)

BTK (32)

CCR (32)

Lipoxygenase (32)

HER (32)

Serotonin Transporter (31)

Antiviral (31)

ADC Cytotoxin (30)

Carbonic Anhydrase (29)

E1/E2/E3 Enzyme (29)

NOS (28)

CXCR (28)

CaMK (28)

Nrf2 (28)

p53 (28)

Gamma-secretase (27)

Casein Kinase (27)

Histone Demethylase (26)

Trk receptor (26)

ribosome (26)

c-RET (26)

TAM Receptor (26)

LPL Receptor (25)

Serine Protease (25)

P2X Receptor (25)

HIF (25)

Neurokinin receptor (25)

Antifection (24)

IGF-1R (24)

FAK (24)

Chloride channel (23)

Norepinephrine (23)

DUB (23)

Retinoid Receptor (23)

S6 Kinase (23)

S1P Receptor (23)

Cysteine Protease (22)

ATM/ATR (22)

Kras (22)

Proton pump (21)

Transferase (21)

Amino Acids and Derivatives (21)

Fatty Acid Synthase (21)

Hedgehog/Smoothened (21)

Histone Acetyltransferase (21)

Progesterone Receptor (20)

Glucagon Receptor (20)

DPP-4 (20)

Indoleamine 2,3-Dioxygenase (IDO) (20)

c-Fms (20)

Thyroid hormone receptor(THR) (19)

DNA Alkylator/Crosslinker (19)

NADPH (19)

FXR (19)

Glucosidase (19)

FAAH (19)

Chk (19)

PLK (19)

HMG-CoA Reductase (19)

Protease-activated Receptor (19)

Reductase (18)

RIP kinase (18)

Ligand for E3 Ligase (18)

Aryl Hydrocarbon Receptor (17)

Guanylate cyclase (17)

LRRK2 (17)

transporter (17)

Thrombin (17)

PROTACs (16)

Smo (16)

PDK (16)

NOD (16)

DNA Methyltransferase (16)

Kinesin (16)

PERK (15)

GNRH Receptor (15)

Acyltransferase (15)

STING (15)

Melanocortin Receptor (15)

AhR (15)

Mdm2 (14)

P2Y Receptor (14)

MRP (14)

Glucokinase (14)

Neuropeptide Y Receptor (14)

Endothelin Receptor (14)

OX Receptor (14)

Syk (14)

Sigma receptor (14)

NOD-like Receptor (NLR) (14)

BACE (13)

Lipase (13)

Factor Xa (13)

Rho (13)

Antifolate (13)

Immunology/Inflammation related (13)

DNA Alkylation (13)

Bradykinin Receptor (13)

Epoxide Hydrolase (13)

SGLT (13)

CFTR (13)

ROR (12)

Glutathione Peroxidase (12)

c-Myc (12)

IRE1 (12)

Vasopressin Receptor (12)

PGE Synthase (12)

Complement System (12)

DHFR (11)

CSF-1R (11)

DNA gyrase (11)

PROTAC Linker (11)

Beta-Secretase (11)

Aminopeptidase (11)

Ephrin Receptor (11)

Aromatase (11)

Hydroxylase (11)

IRAK (11)

LTR (10)

ABC (10)

Pim (10)

Liver X Receptor (10)

Isocitrate Dehydrogenase (IDH) (10)

PAK (10)

Stearoyl-CoA Desaturase (SCD) (10)

GPCR19 (10)

ADC Linker (10)

LPA Receptor (10)

GHSR (10)

Leukotriene Receptor (9)

IDO (9)

IAP (9)

Myosin (9)

DNA (9)

Gap Junction Protein (9)

ROS Kinase (9)

PD-1/PD-L1 (9)

CAT (8)

Monocarboxylate transporter (8)

IFNAR (8)

DYRK (8)

NAMPT (8)

Vitamin (8)

Phosphorylase (8)

PAD (8)

Xanthine Oxidase (8)

RSV (8)

Acetyl-CoA Carboxylase (8)

cholecystokinin (8)

Arginase (7)

Melatonin Receptor (7)

Neurotensin Receptor (7)

UGT (7)

Monoamine Transporter (7)

cAMP (7)

ATP Citrate Lyase (7)

Porcupine (7)

PAI-1 (7)

Neprilysin (7)

GST (7)

Discoidin Domain Receptor (DDR) (7)

MLK (7)

CRM1 (6)

Ligands for Target Protein for PROTAC (6)

YAP (6)

Arrestin (6)

Tie-2 (6)

GTPase (6)

CaSR (6)

GRK (6)

Telomerase (6)

Lipid (6)

BCRP (6)

MNK (6)

PI4K (6)

Oxytocin Receptor (6)

Platelet aggregation (6)

p97 (6)

Imidazoline Receptor (6)

PKM (6)

DprE1 (5)

Na+/Ca2+ Exchanger (5)

CETP (5)

OCT (5)

LIM Kinase (5)

PYK2 (5)

LDL (5)

MT Receptor (5)

Bombesin Receptor (5)

ACK (5)

Free radical scavengers (5)

CRISPR/Cas9 (5)

CGRP Receptor (5)

SGK (5)

advanced glycation end products (4)

Adenylyl cyclase (4)

NPC1L1 (4)

NEDD8 (4)

TOPK (4)

cell cycle arrest (4)

Glutaminase (4)

Annexin A (4)

FLAP (4)

Adiponectin receptor (4)

PAFR (4)

GlyT (4)

APC (4)

Somatostatin (4)

OAT (4)

cGAS (4)

ASK (4)

Carboxypeptidase (4)

Adenosine deaminase (4)

Apelin receptor (3)

Piezo Channel (3)

Dynamin (3)

MyD88 (3)

E3 Ligase Ligand-Linker Conjugate (3)

Cell wall (3)

Galectin (3)

Kisspeptin (3)

SIK (3)

MTH1 (3)

Hexokinase (3)

Molecular Glues (3)

MAGL (3)

PTEN (3)

Thrombopoietin Receptor (3)

Mucin (3)

OXPHOS (3)

PSMA (3)

Decarboxylase (3)

TSH Receptor (3)

CRFR (3)

Pyroptosis (3)

MELK (3)

Methionine Adenosyltransferase (MAT) (3)

Hippo pathway (3)

GPX (3)

KLF (3)

BMI-1 (3)

Melanin-concentrating Hormone Receptor (MCHR) (2)

MALT (2)

EBI2/GPR183 (2)

Sodium-dependent phosphate transporter (2)

RAR/RXR (2)

VDA (2)

VDAC (2)

Hck (2)

RANKL/RANK (2)

Haspin Kinase (2)

Na-K-Cl cotransporter (2)

Integrase (2)

HCN Channel (2)

PGC-1α (2)

KSP (2)

Wee1 (2)

Glutathione reductase (2)

Survivin (2)

MRGPR (2)

CD73 (2)

GluCls (2)

Aquaporin (2)

NADPH-oxidase (2)

Amylin Receptor (2)

lysosomal autophagy (2)

Taste receptor (1)

Transaminase (1)

Hydrogenase (1)

CD38 (1)

CYP19A1 (1)

aconitase (1)

gp120/CD4 (1)

LHRH (1)

N-Acetylglucosaminyltransferase (1)

Stemness kinase (1)

FOXO1 (1)

Amylase (1)

Prolyl Endopeptidase (PREP) (1)

Motilin Receptor (1)

Fas/FasL (1)

FABP (1)

PACAP (1)

AAK1 (AP2 associated kinase 1) (1)

Anion Exchanger (1)

Thioredoxin (1)

hCE (1)

ATTECs (1)

Fer/FerT kinase (1)

NMU2R (1)

化合物库信息示例

Empty	1000025-07-9	1000413-72-8	229005-80-5	1000787-75-6	946387-07-1	1000998-59-3	1175526-27-8	1001288-58-9	1001350-96-4	1001404-83-6	Empty
Empty	Vadadustat	TAK875	TAK-779	Tegobuvir	RN-1734	BMS-687453	AM211	FT011	BMS754807	AAI101	Empty
Empty	1001625-82-6	1001645-58-4	1001753-24-7	1001908-89-9	1002304-34-8	1002-84-2	100291-86-9	100299-08-9	10030-52-1	10040-45-6	Empty
Empty	RPW-24	SRT1720 hydrochloride	INH6	SRT 2183	AMG208	Pentadecanoic acid	Apiopaeonoside	Pemirolast potassium	L-Anserine nitrate salt	Sodium Picosulfate	Empty
Empty	100427-26-7	1004316-88-4	10045-45-1	100462-37-1	1004990-28-6	100-51-6	1005-24-9	1005264-47-0	1005334-57-5	1005342-46-0	Empty
Empty	Lercanidipine	Cobicistat	1-Ethyl-2-benzimidazolinone	ROSIRIDIN	PF-AKT400	Benzyl alcohol	1-Methylnicotinamide chloride	MX69	CVT-10216	LCL161	Empty
Empty	1005491-05-3	100-55-0	1005504-62-0	1005883-72-6	100643-71-8	1007207-67-1	10075-50-0	1007647-73-5	100784-20-1	10083-24-6	Empty
Empty	Tirasemtiv	Roniacol	Rg3039	Z433927330	Desloratadine	CH5132799	5-Bromoindole	Smurf1-IN-A01	Halosulfuron-methyl	Piceatannol	Empty
Empty	100872-83-1	100874-08-6	1009119-64-5	1009119-65-6	100929-71-3	1009298-09-2	1009298-59-2	100929-99-5	1009734-33-1	10097-84-4	Empty
Empty	ML346	SB 4	Daclatasvir	Daclatasvir dihydrochloride	NADPH (tetracyclohexanamine)	AZD8055	Vistusertib	PAβN dihydrochloride	HZ1157	Rotundine	Empty
Empty	1009816-48-1	1009817-63-3	1009820-21-6	100986-85-4	101001-34-7	1010411-21-8	1010-60-2	1011244-68-0	1011301-27-1	1011529-10-4	Empty
Empty	Thiamet G	B-AP15	Silmitasertib	Levofloxacin	Pamicogrel	GSK369796 Dihydrochloride	2-Chloronaphthoquinone	TFAP	Tenovin3	Azvudine	Empty
Empty	101152-94-7	101155-02-6	1011557-82-6	1011-74-1	101-20-2	1012054-59-9	101-21-3	101-26-8	101303-98-4	1013101-36-4	Empty
Empty	Milnacipran hydrochloride	BW-A78U	Tenovin-6	DL-Normetanephrine hydrochloride	Triclocarban	CUDC101	Chlorpropham	Mestinon	Zacopride hydrochloride	PF04691502	Empty
Empty	101-31-5	1013-69-0	1013750-77-0	1013753-99-5	10138-52-0	1013920-15-4	1013937-63-7	1014691-61-2	101477-54-7	101494-95-5	Empty
Empty	L-Hyoscyamine	Noreugenin	ML-030	BC-1382	Gadolinium chloride	Vorolanib	VTP-27999 TFA	GSK0660	Lomerizine hydrochloride	8-CHLOROQUINAZOLIN-4(1H)-ONE	Empty

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