Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Oxalic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 3/20 | 0.63 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.49 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.49 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.49 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.49 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.43 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.43 |
| ▸ | HTR5A | P47898 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.42 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.42 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.41 |
| ▸ | MTNR1A | P48039 | 5/20 | 0.41 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.38 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8547530 | 0.91 | CYP2A6 (0.75) | CYP2A6CA2HDAC10HDAC11HDAC8 | |
| Hydrochloric Acid SCHEMBL23012014 | 0.90 | CYP2A6 (0.73) | CYP2A6CA2HDAC10HDAC11HDAC8 | |
| SCHEMBL8253324 | 0.82 | CYP2A6 (0.58) | CYP2A6CA2HDAC10HDAC11HDAC8 | |
| Oxalic Acid SCHEMBL8547933 | 0.82 | CYP2A6 (0.51) | CYP2A6CA2HDAC10HDAC11HDAC8 | |
| SCHEMBL8246357 | 0.80 | CYP2A6 (0.55) | CYP2A6CA2HDAC10HDAC11HDAC8 | |
| SCHEMBL7429693 | 0.79 | KEAP1 (0.68) | CYP2A6CA2HDAC10HDAC11HDAC8 | |
| SCHEMBL8610344 | 0.79 | CYP2A6 (0.56) | CYP2A6CA2HDAC10HDAC11HDAC8 | |
| SCHEMBL3576292 | 0.78 | CYP2A6 (1.00) | CYP2A6CA2HDAC10HDAC11HDAC8 | |
| SCHEMBL28563290 | 0.78 | CYP2A6 (0.64) | CYP2A6CA2HDAC10HDAC11HDAC8 | |
| SCHEMBL31588788 | 0.77 | CYP2A6 (0.67) | CYP2A6CA2HDAC10HDAC11HDAC8 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5792763-A | MIGRAINES; ANALGESICS; DISEASES LINKED TO DECREASED NEUROTRANMISSION OF SEROTONIN IN MAMMALS | ELI LILLY AND COMPANY (US) | 1998-08-11 | — | — | US | disclosed |
| WO-1998015545-A1 | NEW SEROTONIN 5-HT1F AGONISTS | ELI LILLY AND COMPANY (US) | 1998-04-16 | — | — | WO | disclosed |
| EP-0835869-A2 | New serotonin 5-HT1F agonists | ELI LILLY AND COMPANY (US) | 1998-04-15 | — | — | EP | disclosed |