Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.46 |
| ▸ | ADRB2 | P07550 | 4/20 | 0.44 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.44 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.44 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.44 |
| ▸ | SLC18A2 | Q05940 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL19061658 | 1.00 | HIF1A (0.48) | HIF1ACYP3A4TSHRALDH1A1ALOX15 | |
| SCHEMBL19061898 | 0.86 | KDM4E (0.42) | HIF1ACYP3A4TSHRALDH1A1ALOX15 | |
| SCHEMBL30211141 | 0.86 | KMT2A (0.43) | HIF1ACYP3A4ALOX15MAPK1OPRK1 | |
| SCHEMBL30211116 | 0.86 | KDM4E (0.42) | HIF1ACYP3A4ALDH1A1ALOX15MAPK1 | |
| SCHEMBL23929159 | 0.86 | KMT2A (0.43) | HIF1ACYP3A4ALOX15MAPK1OPRK1 | |
| SCHEMBL23929216 | 0.86 | KDM4E (0.42) | HIF1ACYP3A4ALDH1A1ALOX15MAPK1 | |
| SCHEMBL23929162 | 0.86 | KMT2A (0.43) | HIF1ACYP3A4ALOX15MAPK1OPRK1 | |
| SCHEMBL23929213 | 0.86 | KDM4E (0.42) | HIF1ACYP3A4ALDH1A1ALOX15MAPK1 | |
| SCHEMBL19061633 | 0.86 | NLRP3 (0.49) | HIF1ACYP3A4ALOX15MAPK1ADRB2 | |
| SCHEMBL19061767 | 0.86 | NLRP3 (0.49) | HIF1ACYP3A4ALOX15MAPK1ADRB2 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115667275-B | Boron-containing compounds and uses thereof | 南京再明医药有限公司 | 2024-02-23 | — | — | CN | disclosed |
| CN-115667275-A | Boron-containing compounds and their use | 先声药业有限公司 | 2023-01-31 | — | — | CN | disclosed |
| WO-2021213358-A1 | BORON-CONTAINING COMPOUNDS AND APPLICATION THEREOF | 江苏先声药业有限公司 (CN) | 2021-10-28 | — | — | WO | disclosed |
| CN-107428721-B | Benzopiperidine derivative, preparation method and medical application thereof | 江苏恒瑞医药股份有限公司 | 2020-07-28 | — | — | CN | disclosed |
| CN-107428721-A | Benzo piperidine derivatives, its preparation method and its application in medicine | 江苏恒瑞医药股份有限公司 | 2017-12-01 | — | — | CN | disclosed |