Hydrogen Peroxide

Hydrogen Peroxide

SCHEMBL9681552

NC(=O)C1=CN([C@@H]2O[C@H](COP(=O)(O)OP(=O)(O)OC[C@H]3O[C@@H](n4cnc5c(N)ncnc54)[C@H](O)[C@@H]3O)[C@@H](O)[C@H]2O)C=CC1.OO

nearest known ligand 0.98

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ADH1A P07327 2/20 0.98
▸ LMNA P02545 1/20 0.74
▸ PMP22 Q01453 1/20 0.74
▸ TP53 P04637 1/20 0.74
▸ TSHR P16473 1/20 0.74
▸ ALOX12 P18054 1/20 0.74
▸ P2RY1 P47900 6/20 0.72
▸ P2RY2 P41231 2/20 0.72
▸ SRC P12931 1/20 0.72
▸ P2RX1 P51575 1/20 0.72
▸ P2RX3 P56373 1/20 0.72
▸ P2RX4 Q99571 1/20 0.72
▸ P2RX2 Q9UBL9 1/20 0.72
▸ ALDH1A1 P00352 1/20 0.72
▸ SMN1; SMN2 Q16637 1/20 0.72
▸ LDHA P00338 1/20 0.71
▸ LDHB P07195 1/20 0.71
▸ MACROD2 A1Z1Q3 1/20 0.68
▸ SIRT6 Q8N6T7 1/20 0.68
▸ MACROD1 Q9BQ69 1/20 0.68

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
SCHEMBL29548827 0.99 ADH1A (1.00) ADH1ALMNAPMP22TP53TSHR
SCHEMBL29351291 0.99 ADH1A (1.00) ADH1ALMNAPMP22TP53TSHR
SCHEMBL29740660 0.99 ADH1A (1.00) ADH1ALMNAPMP22TP53TSHR
SCHEMBL8187 0.99 ADH1A (1.00) ADH1ALMNAPMP22TP53TSHR
SCHEMBL1276381 0.99 ADH1A (1.00) ADH1ALMNAPMP22TP53TSHR
SCHEMBL29350404 0.99 ADH1A (1.00) ADH1ALMNAPMP22TP53TSHR
SCHEMBL8003782 0.99 ADH1A (1.00) ADH1ALMNAPMP22TP53TSHR
SCHEMBL8188 0.99 ADH1A (1.00) ADH1ALMNAPMP22TP53TSHR
SCHEMBL20202727 0.99 ADH1A (1.00) ADH1ALMNAPMP22TP53TSHR
SCHEMBL25792100 0.99 ADH1A (1.00) ADH1ALMNAPMP22TP53TSHR

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1168713-C Synthetic routes to rhinovirus protease inhibitors and key intermediates ������ҩ�����޹�˾ 2004-09-29 — — CN disclosed
CN-1524960-A Processes and intermediates for the preparation of isoxazole carboxamides and analogues thereof ������ҩ�����޹�˾ 2004-09-01 — — CN disclosed
CN-1157391-C Processes and intermediates for the preparation of isoxazole carboxamides and analogues thereof ������ҩ�����޹�˾ 2004-07-14 — — CN disclosed
CN-1382139-A Process and intermediates for the preparation of iso-a-oxazole carboxamides and their analogues AGOURON PHARMA (US) 2002-11-27 — — CN disclosed
US-5100795-A BILE ACID SULFATE SULFATASE, PROCESS FOR ITS PREPARATION AND METHOD FOR ASSAYING BILE ACID MARUKIN SHOYU CO., LTD. (JP) 1992-03-31 — — US disclosed
US-5091305-A For specifically hydrolyzing the sulfate ester moiety of bile acid sulfate sulfatase MARUKIN SHOYU CO., LTD. (JP) 1992-02-25 — — US disclosed
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