Thioguanine

Thioguanine

SCHEMBL1445605

Nc1nc2nc[nH]c2c(=S)[nH]1.Sc1ncnc2nc[nH]c12

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

IMPDH1IMPDH2

The experimentally established mechanism targets of Thioguanine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PNP P00491 1/20 0.48
▸ PI4KA P42356 2/20 0.45
▸ PI4K2B Q8TCG2 2/20 0.45
▸ PI4K2A Q9BTU6 2/20 0.45
▸ PI4KB Q9UBF8 2/20 0.45
▸ XDH P47989 2/20 0.45
▸ LRRK2 Q5S007 2/20 0.45
▸ LMNA P02545 1/20 0.45
▸ DRD3 P35462 1/20 0.45
▸ TP53 P04637 3/20 0.41
▸ USP2 O75604 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ ADORA3 P0DMS8 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ PTGS1 P23219 1/20 0.41
▸ MAPK3 P27361 1/20 0.41
▸ HBB P68871 1/20 0.41
▸ PAX8 Q06710 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ PDPK1 O15530 3/20 0.37

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Thioguanine SCHEMBL1829350 0.93 PNP (0.42) PNPPI4KAPI4K2BPI4K2API4KB
Thioguanine SCHEMBL1176577 0.85 PNP (0.62) PNPPI4KAPI4K2BPI4K2API4KB
Thioguanine SCHEMBL3701 0.85 PNP (0.62) PNPPI4KAPI4K2BPI4K2API4KB
Thioguanine SCHEMBL11551825 0.85 PNP (0.43) PNPPI4KAPI4K2BPI4K2API4KB
Thioguanine SCHEMBL27833745 0.83 PNP (0.61) PNPPI4KAPI4K2BPI4K2API4KB
Thioguanine SCHEMBL28385604 0.83 PNP (0.61) PNPPI4KAPI4K2BPI4K2API4KB
Thioguanine SCHEMBL27871419 0.83 PNP (0.61) PNPPI4KAPI4K2BPI4K2API4KB
Thioguanine SCHEMBL28189108 0.83 PNP (0.61) PNPPI4KAPI4K2BPI4K2API4KB
Thioguanine SCHEMBL28849539 0.81 PNP (0.57) PNPPI4KAPI4K2BPI4K2API4KB
Thioguanine SCHEMBL15285091 0.78 PNP (0.51) PNPPI4KAPI4K2BPI4K2API4KB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0105404-A1 Derivatives of steroid compounds linked to cyotoxic agents and process for their preparation MERCK & CO. INC. (US) 1984-04-18 — — EP claimed
CN-112584824-B Nanoparticles 新泰福托特股份有限公司 2024-03-29 — — CN disclosed
CN-116209439-A Substituted N- (2, 6-dioxopiperidin-3-yl) -1, 3-dioxoisoindolin-5-yl) arylsulfonamide analogs as cereblon modulators 圣裘德儿童研究医院有限公司 2023-06-02 — — CN disclosed
CN-114901366-A RAS inhibitors 锐新医药公司 2022-08-12 — — CN disclosed
US-8460663-B2 Stabilized liquid anti-RSV antibody formulations MEDIMMUNE, LLC (US) 2013-06-11 — — US disclosed
US-20120321616-A1 STABILIZED LIQUID ANTI-RSV ANTIBODY FORMULATIONS MEDLMMUNE, LLC (US) 2012-12-20 — — US disclosed
WO-2011037973-A1 \"CLICK\" NANOPARTICLE CONJUGATES NORTHWESTERN UNIVERSITY (US) 2011-03-31 — — WO disclosed
CN-1901939-A Treatment of Proliferative Diseases Using Antisense IAP Oligomers and Chemotherapeutic Agents AEGERA THERAPEUTICS INC (CA) 2007-01-24 — — CN disclosed
EP-1451205-A2 ANTISENSE THERAPY USING OLIGONUCLEOTIDES THAT TARGET HUMAN KINESIN GENES FOR TREATMENT OF CANCER CHIRON CORPORATION (US) 2004-09-01 — — EP disclosed
US-20040009156-A1 Antisense therapy using oligonucleotides that target human kinesin genes for treatment of cancer REINHARD CHRISTOPH (US) 2004-01-15 — — US disclosed
WO-2003030832-A2 ANTISENSE THERAPY USING OLIGONUCLEOTIDES THAT TARGET HUMAN KINESIN GENES FOR TREATMENT OF CANCER CHIRON CORPORATION (US) 2003-04-17 — — WO disclosed
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