Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Pyrogallol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 6/20 | 0.75 |
| ▸ | CA1 | P00915 | 5/20 | 0.75 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.75 |
| ▸ | HPGD | P15428 | 5/20 | 0.75 |
| ▸ | LMNA | P02545 | 4/20 | 0.75 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.75 |
| ▸ | CA6 | P23280 | 3/20 | 0.75 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.75 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.75 |
| ▸ | MMP2 | P08253 | 2/20 | 0.75 |
| ▸ | EGFR | P00533 | 2/20 | 0.75 |
| ▸ | FYN | P06241 | 2/20 | 0.75 |
| ▸ | MMP9 | P14780 | 2/20 | 0.75 |
| ▸ | RECQL | P46063 | 2/20 | 0.75 |
| ▸ | ADAMTS4 | O75173 | 1/20 | 0.75 |
| ▸ | MMP8 | P22894 | 1/20 | 0.75 |
| ▸ | CDK2 | P24941 | 1/20 | 0.75 |
| ▸ | MMP12 | P39900 | 1/20 | 0.75 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.75 |
| ▸ | CA12 | O43570 | 5/20 | 0.57 |
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 | |
|---|---|---|---|---|
| Pyrogallol SCHEMBL8433563 | 0.88 | CA1 (0.67) | CA2CA1ALDH1A1HPGDLMNA | |
| Pyrogallol SCHEMBL9797828 | 0.88 | CA1 (0.67) | CA2CA1ALDH1A1HPGDLMNA | |
| Pyrogallol SCHEMBL170157 | 0.87 | ALDH1A1 (1.00) | CA2CA1ALDH1A1HPGDLMNA | |
| Pyrogallol SCHEMBL3532 | 0.87 | — | — | |
| Pyrogallol SCHEMBL225781 | 0.85 | CA1 (0.71) | CA2CA1ALDH1A1HPGDLMNA | |
| Pyrogallol SCHEMBL483095 | 0.84 | ALDH1A1 (0.80) | CA2CA1ALDH1A1HPGDLMNA | |
| Pyrogallol SCHEMBL2063415 | 0.84 | ALDH1A1 (0.80) | CA2CA1ALDH1A1HPGDLMNA | |
| Pyrogallol SCHEMBL9215733 | 0.84 | CA1 (0.60) | CA2CA1ALDH1A1HPGDLMNA | |
| Pyrogallol SCHEMBL11661058 | 0.83 | ALDH1A1 (0.92) | CA2CA1ALDH1A1HPGDLMNA | |
| Pyrogallol SCHEMBL10986410 | 0.83 | ALDH1A1 (0.92) | CA2CA1ALDH1A1HPGDLMNA |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0451435-A1 | Wood impregnation agents | Haltmeier, Georg, Dipl.-Ing. (AT) | 1991-10-16 | — | — | EP | claimed |
| US-20120301594-A1 | ROASTED GREEN TEA BEVERAGE PACKED IN A CONTAINER | ITO EN, LTD. | 2012-11-29 | — | — | US | disclosed |
| EP-0839145-B1 | HETEROCYCLYLCARBOXAMIDE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS | ABBOTT GMBH & CO KG (DE) | 2003-11-05 | — | — | EP | disclosed |
| US-5935973-A | AFFINITY FOR 5-HT1A, ALPHA1, ALPHA2 AND/OR D2 RECEPTORS; ANTIDEPRESSANTS, ANXIOLYTIC AGENTS, PSYCHOSES, DYSKINESIAS, PARKINSON'S DISEASE, HYPOTENSIVE AGENTS, TOURETTE'S SYNDROME, OBSESSIVE-COMPULSIVE BEHAVIOUR, PANIC ATTACKS, SOCIAL PHOBIAS | KNOLL AKTIENGESELLSCHAFT (DE) | 1999-08-10 | — | — | US | disclosed |
| EP-0839145-A1 | HETEROCYCLYLCARBOXAMIDE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS | Knoll AG (DE) | 1998-05-06 | — | — | EP | disclosed |
| WO-1997003071-A1 | HETEROCYCLYLCARBOXAMIDE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS | KNOLL AKTIENGESELLSCHAFT (DE) | 1997-01-30 | — | — | WO | disclosed |
| EP-0451435-A1 | Wood impregnation agents | Haltmeier, Georg, Dipl.-Ing. (AT) | 1991-10-16 | — | — | EP | disclosed |
| EP-0451435-A1 | Wood impregnation agents | Haltmeier, Georg, Dipl.-Ing. (AT) | 1991-10-16 | — | — | EP | disclosed |
| US-3987004-A | CYCLIC CARBONATE, AMINE ANTIOXIDANT | NATIONAL STARCH AND CHEMICAL CORPORATION (US) | 1976-10-19 | — | — | US | disclosed |
| US-3985705-A | AGAINST THERMAL DEGRADATION | NATIONAL STARCH AND CHEMICAL CORPORATION (US) | 1976-10-12 | — | — | US | disclosed |