Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.68 |
| ▸ | CA1 | P00915 | 1/20 | 0.68 |
| ▸ | CA2 | P00918 | 1/20 | 0.68 |
| ▸ | CA9 | Q16790 | 1/20 | 0.68 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.67 |
| ▸ | MEN1 | O00255 | 1/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.58 |
| ▸ | PKM | P14618 | 1/20 | 0.58 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.53 |
| ▸ | SRC | P12931 | 1/20 | 0.52 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.50 |
| ▸ | NAMPT | P43490 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL29176349 | 0.91 | SRC (0.57) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL2735969 | 0.85 | CA12 (0.72) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL12779572 | 0.84 | ROCK2 (0.70) | KMT2AMEN1KDM4EHPGDMAPT | |
| SCHEMBL20267074 | 0.81 | ALOX15 (0.53) | KDM4ENPC1RAB9AHDAC2HDAC3 | |
| SCHEMBL20534714 | 0.81 | ALOX15 (0.70) | KMT2AMEN1HDAC2HDAC3HDAC1 | |
| SCHEMBL29176363 | 0.80 | NPC1 (0.71) | NPC1RAB9A | |
| SCHEMBL4193034 | 0.79 | MEN1 (0.73) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL20267061 | 0.79 | HDAC1 (0.57) | KDM4EHDAC2HDAC3HDAC1 | |
| SCHEMBL2760003 | 0.77 | SRC (0.83) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL14845701 | 0.76 | KDM4E (0.72) | CA12CA1CA2CA9KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024109642-A1 | USE OF BENZOAZACYCLIC COMPOUND AS ALLOSTERIC MODULATOR OF β2-ADRENOCEPTOR | 常州大学 | 2024-05-30 | — | — | WO | disclosed |
| CN-117447381-A | Indole amide derivative and its application in preparing beta 2 Use of adrenoreceptor allosteric antagonist medicaments | 常州大学 | 2024-01-26 | — | — | CN | disclosed |