Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NHERF1 | O14745 | 5/20 | 0.63 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.58 |
| ▸ | TMPRSS4 | Q9NRS4 | 1/20 | 0.57 |
| ▸ | CFTR | P13569 | 1/20 | 0.57 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
| ▸ | AVPR1A | P37288 | 2/20 | 0.51 |
| ▸ | F7 | P08709 | 1/20 | 0.50 |
| ▸ | F3 | P13726 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.48 |
| ▸ | BACE1 | P56817 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL398244 | 0.91 | CFTR (0.71) | NHERF1NR4A2TMPRSS4CFTRMAOB | |
| SCHEMBL29176623 | 0.89 | NHERF1 (0.79) | NHERF1NR4A2TMPRSS4CFTRF7 | |
| SCHEMBL13043506 | 0.86 | RAB9A (0.71) | NR4A2MEN1KMT2ANPC1RAB9A | |
| SCHEMBL31448058 | 0.84 | NPC1 (0.53) | NHERF1NR4A2TMPRSS4CFTRMEN1 | |
| SCHEMBL29176352 | 0.83 | CFTR (0.57) | NHERF1CFTRDGAT1MEN1KMT2A | |
| SCHEMBL10260257 | 0.83 | CFTR (0.57) | NHERF1CFTRDGAT1MEN1KMT2A | |
| SCHEMBL20567521 | 0.83 | STING1 (0.64) | NHERF1CFTRMEN1KMT2ANPC1 | |
| SCHEMBL18229436 | 0.83 | CFTR (0.71) | NHERF1NR4A2TMPRSS4CFTRF7 | |
| SCHEMBL30695128 | 0.82 | NHERF1 (0.65) | NHERF1CFTRMEN1KMT2ANPC1 | |
| SCHEMBL29176615 | 0.82 | NHERF1 (0.65) | NHERF1CFTRMEN1KMT2ANPC1 |
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 |