Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
| ▸ | RXRA | P19793 | 5/20 | 0.57 |
| ▸ | RXRB | P28702 | 4/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | TTR | P02766 | 1/20 | 0.55 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.52 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.52 |
| ▸ | BAD | Q92934 | 1/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | CA2 | P00918 | 2/20 | 0.48 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA3 | P07451 | 1/20 | 0.48 |
| ▸ | TYR | P14679 | 1/20 | 0.48 |
| ▸ | DRD1 | P21728 | 1/20 | 0.48 |
| ▸ | CA4 | P22748 | 1/20 | 0.48 |
| ▸ | CA6 | P23280 | 1/20 | 0.48 |
| ▸ | CA5A | P35218 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL24733376 | 0.95 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2RXRARXRBTP53 | |
| SCHEMBL16749644 | 0.94 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2RXRARXRBTP53 | |
| SCHEMBL146805 | 0.92 | RXRA (0.50) | ALDH1A1SMN1; SMN2RXRARXRBTP53 | |
| SCHEMBL29624164 | 0.91 | ALDH1A1 (0.58) | ALDH1A1SMN1; SMN2RXRARXRBTP53 | |
| SCHEMBL17069702 | 0.90 | RXRA (0.48) | ALDH1A1SMN1; SMN2RXRARXRBTP53 | |
| SCHEMBL28726923 | 0.87 | RXRA (0.55) | ALDH1A1SMN1; SMN2RXRARXRBTP53 | |
| SCHEMBL24734312 | 0.86 | RXRA (0.53) | ALDH1A1SMN1; SMN2RXRARXRBTP53 | |
| SCHEMBL11219580 | 0.85 | TSHR (0.71) | ALDH1A1SMN1; SMN2RXRARXRBTP53 | |
| SCHEMBL23202551 | 0.82 | TSHR (0.67) | RXRARXRBTP53TSHRTTR | |
| SCHEMBL8848509 | 0.81 | RXRA (0.48) | ALDH1A1SMN1; SMN2RXRARXRBTP53 |
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-114426671-A | Metal organic framework material, preparation method and application | 中国石油天然气股份有限公司 | 2022-05-03 | — | — | CN | claimed |
| US-20240424488-A1 | High-Entropy Metal-Organic Frameworks | NATIONAL TECHNOLOGY & ENGINEERING SOLUTIONS OF SANDIA, LLC | 2024-12-26 | — | — | US | disclosed |
| CN-114426671-B | Metal organic framework material and preparation method and application thereof | 中国石油天然气股份有限公司 | 2023-10-31 | — | — | CN | disclosed |
| CN-114426671-A | Metal organic framework material, preparation method and application | 中国石油天然气股份有限公司 | 2022-05-03 | — | — | CN | disclosed |