Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CFTR | P13569 | 3/20 | 0.57 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 3/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | TDO2 | P48775 | 2/20 | 0.51 |
| ▸ | IDO1 | P14902 | 1/20 | 0.51 |
| ▸ | HTR2C | P28335 | 1/20 | 0.48 |
| ▸ | NHERF1 | O14745 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | AVPR2 | P30518 | 1/20 | 0.46 |
| ▸ | GPR27 | Q9NS67 | 1/20 | 0.46 |
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL29176346 | 0.89 | CFTR (0.60) | CFTRMEN1KMT2ANPC1RAB9A | |
| SCHEMBL28571455 | 0.87 | NHERF1 (0.65) | MEN1KMT2ANPC1RAB9ANHERF1 | |
| SCHEMBL30089269 | 0.87 | NHERF1 (0.65) | MEN1KMT2ANPC1RAB9ANHERF1 | |
| SCHEMBL30912930 | 0.86 | P2RX1 (0.50) | CFTRMEN1KMT2ANPC1RAB9A | |
| SCHEMBL29176341 | 0.86 | P2RX1 (0.50) | CFTRMEN1KMT2ANPC1RAB9A | |
| SCHEMBL29176366 | 0.83 | NHERF1 (0.63) | CFTRDGAT1MEN1KMT2ANPC1 | |
| SCHEMBL10260257 | 0.83 | CFTR (0.57) | CFTRDGAT1MEN1KMT2ANPC1 | |
| SCHEMBL20567516 | 0.83 | STING1 (0.64) | CFTRMEN1KMT2ANPC1RAB9A | |
| SCHEMBL29176625 | 0.82 | MEN1 (0.62) | CFTRMEN1KMT2ANPC1RAB9A | |
| SCHEMBL4430677 | 0.82 | CFTR (0.80) | CFTRMEN1KMT2ANPC1RAB9A |
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 |