Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.73 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.43 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.38 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.38 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.38 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.38 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | TAS1R3 | Q7RTX0 | 2/20 | 0.34 |
| ▸ | TAS1R1 | Q7RTX1 | 2/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL7639 | 0.86 | ALDH1A1 (1.00) | ALDH1A1TSHRTDP1HDAC8CHRNB2 | |
| SCHEMBL473081 | 0.86 | ALDH1A1 (1.00) | ALDH1A1TSHRTDP1HDAC8CHRNB2 | |
| Styrene SCHEMBL9602486 | 0.85 | ALDH1A1 (0.78) | ALDH1A1TSHRTDP1HDAC8TP53 | |
| Water SCHEMBL20378930 | 0.82 | ALDH1A1 (0.92) | ALDH1A1TSHRTDP1HDAC8CHRNB2 | |
| SCHEMBL22496003 | 0.82 | ALDH1A1 (0.92) | ALDH1A1TSHRTDP1HDAC8CHRNB2 | |
| Hydrochloric Acid SCHEMBL23581954 | 0.82 | ALDH1A1 (0.92) | ALDH1A1TSHRTDP1HDAC8CHRNB2 | |
| SCHEMBL6935569 | 0.82 | ALDH1A1 (0.92) | ALDH1A1TSHRTDP1HDAC8CHRNB2 | |
| SCHEMBL29229894 | 0.82 | ALDH1A1 (0.92) | ALDH1A1TSHRTDP1HDAC8CHRNB2 | |
| Ammonia Solution, Strong SCHEMBL28837807 | 0.82 | ALDH1A1 (0.92) | ALDH1A1TSHRTDP1HDAC8CHRNB2 | |
| Ethylene SCHEMBL7955374 | 0.82 | ALDH1A1 (0.92) | ALDH1A1TSHRTDP1HDAC8CHRNB2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1265859-B1 | AMIDINO COMPOUNDS USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS | PHARMACIA CORP (US) | 2005-12-21 | — | — | EP | claimed |
| CN-110100202-A | With the contact lenses for being incorporated to component | 库柏维景国际控股公司 | 2019-08-06 | — | — | CN | disclosed |
| CN-108700676-A | The silicone hydrogel contact lenses of improved lubricity | 库柏维景国际控股公司 | 2018-10-23 | — | — | CN | disclosed |