Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5163572 | 0.83 | APP (0.35) | TRPA1 | |
| SCHEMBL7567519 | 0.81 | KDM4E (0.36) | CA1CA12CA2CA14 | |
| SCHEMBL9749123 | 0.74 | — | — | |
| SCHEMBL3467250 | 0.74 | — | — | |
| SCHEMBL4666266 | 0.73 | CA1 (0.48) | CA1CA12CA2CA14 | |
| SCHEMBL145294 | 0.73 | CHRM2 (0.30) | — | |
| Hydrochloric Acid SCHEMBL5259090 | 0.72 | MEN1 (0.39) | TRPA1 | |
| SCHEMBL5176138 | 0.71 | MAPT (0.38) | — | |
| SCHEMBL4613179 | 0.71 | — | — | |
| SCHEMBL23775289 | 0.70 | CA1 (0.37) | TRPA1CA1CA12CA2CA14 |
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.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012061395-A2 | CYTOTOXIC AGENTS AGAINST CANCER CELLS AND USES THEREOF | REGENTS OF THE UNIVERSITY OF MINNESOTA (US) | 2012-05-10 | — | — | WO | disclosed |
| WO-2011163610-A2 | ANTIMICROBIAL AGENTS | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2011-12-29 | — | — | WO | disclosed |
| WO-2007091950-A1 | BENZIMIDAZOLES AND IMIDAZOPYRIDINES USEFUL IN THE TREATMENT OF DISEASES OR DISORDERS ASSOCIATED WITH CANNABINOID RECEPTOR 2 (CB2) SUCH AS PAIN | ASTRAZENECA AB (SE) | 2007-08-16 | — | — | WO | disclosed |
| EP-1713796-A1 | PROCESS FOR PREPARING SUBSTITUTED BENZOPYRAN COMPOUNDS | SK CHEMICALS CO., LTD. (KR) | 2006-10-25 | — | — | EP | disclosed |
| WO-2005077942-A1 | PROCESS FOR PREPARING SUBSTITUTED BENZOPYRAN COMPOUNDS | SK CHEMICALS, CO., LTD. (KR) | 2005-08-25 | — | — | WO | disclosed |
| EP-0750619-A1 | HETERO-ANNULATED INDAZOLES | BOEHRINGER MANNHEIM ITALIA S.p.A. (IT) | 1997-01-02 | — | — | EP | disclosed |