Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.43 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 3/20 | 0.41 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 2/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | PSEN1 | P49768 | 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 | |
|---|---|---|---|---|
| SCHEMBL452774 | 0.88 | ALDH1A1 (0.46) | ALDH1A1MAPTLMNASMN1; SMN2HTT | |
| SCHEMBL7733558 | 0.85 | CA2 (0.50) | LMNACA1CA2CA12CA9 | |
| SCHEMBL8131241 | 0.85 | ALDH1A1 (0.52) | ALDH1A1MAPTLMNASMN1; SMN2HTT | |
| SCHEMBL7738075 | 0.84 | NR3C2 (0.50) | ALDH1A1MAPTLMNASMN1; SMN2HTT | |
| SCHEMBL7738770 | 0.83 | ALDH1A1 (0.43) | ALDH1A1MAPTLMNASMN1; SMN2HTT | |
| SCHEMBL7738079 | 0.82 | ALDH1A1 (0.39) | ALDH1A1HTTPOLBCA1CA2 | |
| Phenylmethanesulfonic Acid SCHEMBL9078676 | 0.81 | ALDH1A1 (0.45) | ALDH1A1MAPTLMNASMN1; SMN2CA1 | |
| SCHEMBL7739943 | 0.81 | MAOA (0.43) | ALDH1A1MAPTLMNASMN1; SMN2HTT | |
| SCHEMBL2964585 | 0.80 | CA2 (0.48) | ALDH1A1LMNASMN1; SMN2HTTCA1 | |
| SCHEMBL7741651 | 0.80 | LTA4H (0.57) | ALDH1A1LMNAHTTPOLBNPSR1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6416928-B1 | HALOGENONIUM OR SULFONIUM SALTS OF SULFONATED DIPHENYLALKANE | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2002-07-09 | — | — | US | disclosed |