Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BAD | Q92934 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | ALPG | P10696 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11496936 | 0.98 | BAD (0.53) | BADALDH1A1CYP2A6TSHRHSD17B10 | |
| Iodide SCHEMBL4434756 | 0.98 | BAD (0.49) | BADALDH1A1 | |
| Bromide SCHEMBL1866676 | 0.98 | BAD (0.49) | BADALDH1A1CYP2A6TSHRHSD17B10 | |
| Perchlorate SCHEMBL3903408 | 0.92 | RAB9A (0.50) | BADHTTSMN1; SMN2 | |
| Trifluoromethanesulfonic Acid SCHEMBL20495457 | 0.83 | GPR3 (0.39) | BAD | |
| Hydrochloric Acid SCHEMBL11302277 | 0.75 | BAD (0.57) | BADALDH1A1HTTSMN1; SMN2 | |
| SCHEMBL4782479 | 0.73 | ATM (0.43) | ALDH1A1CYP2A6TSHRHSD17B10TDP1 | |
| SCHEMBL19434734 | 0.73 | ALDH1A1 (0.42) | ALDH1A1CYP2A6TSHRHSD17B10TDP1 | |
| SCHEMBL31614554 | 0.72 | RAD52 (0.54) | ALDH1A1CYP2A6TSHRHSD17B10TDP1 | |
| SCHEMBL16736485 | 0.72 | RAD52 (0.54) | ALDH1A1CYP2A6TSHRHSD17B10TDP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112142665-A | Natural-source thioredoxin reductase inhibitor with novel chemical type and application thereof | 兰州大学 | 2020-12-29 | — | — | CN | claimed |
| CN-112142665-A | Natural-source thioredoxin reductase inhibitor with novel chemical type and application thereof | 兰州大学 | 2020-12-29 | — | — | CN | disclosed |
| US-20090173693-A1 | LYOTROPIC LIQUID CRYSTAL MEMBRANES BASED ON CROSS-LINKED TYPE I BICONTINUOUS CUBIC PHASES | NAVY, SECRETARY OF THE UNITED STATES OF AMERICA | 2009-07-09 | — | — | US | disclosed |
| US-6241873-B1 | SOLID ELECTROLYTE FORMED BY HEAT TREATING POLYMER HAVING QUATERNARY AMMONIUM GROUP IN ITS MAIN CHAIN AND HAVING HALIDE ION AS COUNTER ION, AND METAL HALIDE AT AT LEAST 100 DEGREES C. | TDK CORPORATION (JP) | 2001-06-05 | — | — | US | disclosed |