Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | CCR1 | P32246 | 1/20 | 0.30 |
| ▸ | CCR5 | P51681 | 1/20 | 0.30 |
| ▸ | CCR8 | P51685 | 1/20 | 0.30 |
| ▸ | METAP1 | P53582 | 1/20 | 0.30 |
| ▸ | BLM | P54132 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
| ▸ | DOHH | Q9BU89 | 1/20 | 0.30 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19983 | 0.71 | TRPA1 (0.31) | — | |
| Hydrogen Sulfide SCHEMBL27732874 | 0.69 | TRPA1 (0.31) | — | |
| Ammonia Solution, Strong SCHEMBL27596721 | 0.69 | TRPA1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL7403491 | 0.69 | TRPA1 (0.31) | — | |
| SCHEMBL27611235 | 0.69 | TRPA1 (0.31) | — | |
| SCHEMBL27543379 | 0.69 | TRPA1 (0.31) | — | |
| SCHEMBL433359 | 0.69 | TRPA1 (0.31) | — | |
| Pyridine SCHEMBL28084682 | 0.67 | TSHR (0.31) | — | |
| Cycloheptane SCHEMBL27301709 | 0.67 | — | — | |
| SCHEMBL3834762 | 0.64 | MAPT (0.46) | KDM4ELMNACYP1A2POLBBLM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020060427-A1 | N'-[(ANTHRACEN-9-YL)METHYLENE]-2-[4,6-DIMETHYL-2-SULPHANYLPYRIDIN-3-YL-CARBOXAMIDO]ACETIC ACID HYDRAZIDE, METHOD OF ITS PREPARATION AND USE | UNIWERSYTET MEDYCZNY IM. PIASTÓW ŚLĄSKICH WE WROCŁAWIU (PL) | 2020-03-26 | — | — | WO | disclosed |
| WO-2012163236-A1 | PYRIDOTHIAZEPINE DERIVATIVE, PREPARATION METHOD AND USES THEREFOR | 长春吉大天元化学技术股份有限公司 (CN) | 2012-12-06 | — | — | WO | disclosed |
| EP-1194429-B1 | POTASSIUM CHANNEL OPENERS | ABBOTT LAB (US) | 2005-03-30 | — | — | EP | disclosed |