Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.33 |
| ▸ | TXNRD1 | Q16881 | 1/20 | 0.33 |
| ▸ | TXNRD3 | Q86VQ6 | 1/20 | 0.33 |
| ▸ | TXNRD2 | Q9NNW7 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | AHR | P35869 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | PDE2A | O00408 | 1/20 | 0.31 |
| ▸ | DAO | P14920 | 1/20 | 0.30 |
| ▸ | CES2 | O00748 | 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 | |
|---|---|---|---|---|
| SCHEMBL21719649 | 0.75 | GABRA1 (0.33) | ALDH1A1HPGDALOX15TDP1HSD17B10 | |
| SCHEMBL6986501 | 0.73 | DAO (0.40) | ALDH1A1HPGDHSD17B10MEN1KMT2A | |
| SCHEMBL9224370 | 0.72 | KDM4E (0.33) | ALDH1A1TSHRHPGDHSD17B10MEN1 | |
| SCHEMBL28222880 | 0.70 | TSHR (0.38) | ALDH1A1TSHRHPGDHSD17B10MEN1 | |
| SCHEMBL28579313 | 0.70 | LMNA (0.33) | ALDH1A1TSHRHPGDMEN1KMT2A | |
| SCHEMBL29291942 | 0.70 | MEN1 (0.31) | ALDH1A1TSHRHPGDMEN1KMT2A | |
| SCHEMBL17002554 | 0.65 | MEN1 (0.48) | ALDH1A1HPGDHSD17B10MEN1KMT2A | |
| SCHEMBL21793221 | 0.65 | RAF1 (0.33) | ALDH1A1TSHRHPGDCYP3A4MEN1 | |
| SCHEMBL28090101 | 0.65 | ALDH1A1 (0.37) | ALDH1A1HPGDMEN1KMT2APDE2A | |
| SCHEMBL17162885 | 0.65 | MEN1 (0.32) | ALDH1A1HPGDHSD17B10MEN1KMT2A |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107151229-A | A kind of method for producing the trifluoromethyl pyridine of 2 chlorine 4 | 内蒙古佳瑞米精细化工有限公司 | 2017-09-12 | — | — | CN | claimed |
| CN-110267950-A | Substituted heteroaryl pyrrolones and its salt and its purposes as herbicidal active compounds | 拜耳作物科学股份公司 | 2019-09-20 | — | — | CN | disclosed |
| CN-108929336-A | Thiazolopyrimidinone class as the active regulator of nmda receptor | 豪夫迈·罗氏有限公司 | 2018-12-04 | — | — | CN | disclosed |
| CN-106771303-B | One kind is for analyzing conveying device and its working method in heavy metal-polluted soil sample injector | 徐州腾睿智能装备有限公司 | 2018-09-18 | — | — | CN | disclosed |
| CN-105612162-B | Thiazolopyrimidinones as modulators of NMDA receptor activity | 豪夫迈·罗氏有限公司 | 2018-08-21 | — | — | CN | disclosed |
| CN-105764898-A | Heterocyclic amide compounds and herbicides | 先正达参股股份有限公司 | 2016-07-13 | — | — | CN | disclosed |