Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 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 | |
|---|---|---|---|---|
| Iodobenzene SCHEMBL28157391 | 0.98 | ALDH1A1 (0.54) | ALDH1A1HSD17B10LMNATSHRMEN1 | |
| O-Xylene SCHEMBL3225611 | 0.85 | ALDH1A1 (0.64) | ALDH1A1HSD17B10LMNATSHRMEN1 | |
| O-Xylene SCHEMBL27964793 | 0.83 | ALDH1A1 (0.61) | ALDH1A1HSD17B10LMNATSHRMEN1 | |
| Toluene SCHEMBL9466202 | 0.83 | ALDH1A1 (0.61) | ALDH1A1HSD17B10LMNATSHRMEN1 | |
| Toluene SCHEMBL14353557 | 0.83 | ALDH1A1 (0.61) | ALDH1A1HSD17B10LMNATSHRMEN1 | |
| Toluene SCHEMBL9305273 | 0.83 | ALDH1A1 (0.61) | ALDH1A1HSD17B10LMNATSHRMEN1 | |
| Toluene SCHEMBL15348475 | 0.83 | ALDH1A1 (0.61) | ALDH1A1HSD17B10LMNATSHRMEN1 | |
| Toluene SCHEMBL21490912 | 0.83 | ALDH1A1 (0.61) | ALDH1A1HSD17B10LMNATSHRMEN1 | |
| Toluene SCHEMBL8533815 | 0.83 | ALDH1A1 (0.61) | ALDH1A1HSD17B10LMNATSHRMEN1 | |
| Toluene SCHEMBL14353113 | 0.83 | ALDH1A1 (0.61) | ALDH1A1HSD17B10LMNATSHRMEN1 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110128577-A | A kind of methacrylate-based monomer polymerization of near infrared light regulation | 苏州大学 | 2019-08-16 | — | — | CN | claimed |
| CN-106660991-A | Antiproliferative compounds and methods of use thereof | 细胞基因公司 | 2017-05-10 | — | — | CN | disclosed |
| CN-103819470-B | Mesoionic pesticides | 杜邦公司 | 2016-08-24 | — | — | CN | disclosed |
| CN-104356130-A | Mesoionic pesticides | DU PONT | 2015-02-18 | — | — | CN | disclosed |
| CN-102548973-B | Mesoionic insecticides | DU PONT | 2014-11-12 | — | — | CN | disclosed |
| CN-103819470-A | Mesoionic pesticides | DU PONT | 2014-05-28 | — | — | CN | disclosed |
| CN-102548973-A | Mesoionic insecticides | DU PONT | 2012-07-04 | — | — | CN | disclosed |
| CN-1028174-C | Process and intermediates for preparing compounds having disubstituted acetylene moiety and retinoic acid-like biological activity | ALLERGAN INC (US) | 1995-04-12 | — | — | CN | disclosed |
| CN-1050385-A | Preparation has bioactive method and the intermediate that has the compound of disubstituted acetylene moiety of retinoic acid-like | ALLERGAN INC (US) | 1991-04-03 | — | — | CN | disclosed |