Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.55 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.55 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.55 |
| ▸ | ESR1 | P03372 | 3/20 | 0.41 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.41 |
| ▸ | TUBB4A | P04350 | 6/20 | 0.38 |
| ▸ | TUBB | P07437 | 6/20 | 0.38 |
| ▸ | TUBA3C | P0DPH7 | 6/20 | 0.38 |
| ▸ | TUBA1B | P68363 | 6/20 | 0.38 |
| ▸ | TUBA4A | P68366 | 6/20 | 0.38 |
| ▸ | TUBB4B | P68371 | 6/20 | 0.38 |
| ▸ | TUBB3 | Q13509 | 6/20 | 0.38 |
| ▸ | TUBB2A | Q13885 | 6/20 | 0.38 |
| ▸ | TUBB8 | Q3ZCM7 | 6/20 | 0.38 |
| ▸ | TUBA3E | Q6PEY2 | 6/20 | 0.38 |
| ▸ | TUBA1A | Q71U36 | 6/20 | 0.38 |
| ▸ | TUBA1C | Q9BQE3 | 6/20 | 0.38 |
| ▸ | TUBB6 | Q9BUF5 | 6/20 | 0.38 |
| ▸ | TUBB2B | Q9BVA1 | 6/20 | 0.38 |
| ▸ | TUBB1 | Q9H4B7 | 6/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL29501013 | 0.91 | HDAC1 (0.56) | HDAC1HDAC8HDAC6ESR1ESR2 | |
| SCHEMBL29501070 | 0.91 | HDAC1 (0.56) | HDAC1HDAC8HDAC6ESR1ESR2 | |
| SCHEMBL28540721 | 0.91 | HDAC1 (0.64) | HDAC1HDAC8HDAC6ESR1ESR2 | |
| SCHEMBL29501034 | 0.91 | HDAC1 (0.64) | HDAC1HDAC8HDAC6ESR1ESR2 | |
| SCHEMBL29501025 | 0.90 | HDAC1 (0.55) | HDAC1HDAC8HDAC6ESR1ESR2 | |
| SCHEMBL29501040 | 0.90 | HDAC1 (0.57) | HDAC1HDAC8HDAC6ESR1ESR2 | |
| SCHEMBL29500973 | 0.90 | HDAC1 (0.55) | HDAC1HDAC8HDAC6ESR1ESR2 | |
| SCHEMBL29501008 | 0.86 | HDAC1 (0.49) | HDAC1HDAC8HDAC6ESR1ESR2 | |
| SCHEMBL24167472 | 0.81 | HDAC1 (0.65) | HDAC1HDAC8HDAC6ESR1ESR2 | |
| SCHEMBL19423099 | 0.81 | HDAC1 (0.65) | HDAC1HDAC8HDAC6ESR1ESR2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114380728-B | Novel diaryl-beta-lactam organic selenium compound, preparation method and application thereof in pharmacy | 复旦大学 | 2024-04-30 | — | — | CN | disclosed |
| CN-114380728-A | Novel diaryl-beta-lactam organic selenium compound, preparation method and application thereof in pharmacy | 复旦大学 | 2022-04-22 | — | — | CN | disclosed |