Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.56 |
| ▸ | MAOB | P27338 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.55 |
| ▸ | HPGD | P15428 | 3/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.55 |
| ▸ | POLB | P06746 | 2/20 | 0.55 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.55 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.51 |
| ▸ | AURKA | O14965 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL18394876 | 1.00 | MAOA (0.56) | MAOAMAOBALDH1A1HPGDHSD17B10 | |
| SCHEMBL6093502 | 0.88 | RPS6KB1 (0.61) | MAOAMAOBALDH1A1HPGDHSD17B10 | |
| SCHEMBL29232903 | 0.86 | ALDH1A1 (0.53) | MAOAMAOBALDH1A1HPGDHSD17B10 | |
| SCHEMBL30415511 | 0.84 | KDM4E (0.51) | MAOAMAOBALDH1A1HPGDHSD17B10 | |
| SCHEMBL18838080 | 0.84 | KDM4E (0.51) | MAOAMAOBALDH1A1HPGDHSD17B10 | |
| SCHEMBL7461503 | 0.83 | HPGD (0.60) | MAOAMAOBALDH1A1HPGDPOLB | |
| SCHEMBL1467625 | 0.83 | MAOA (0.54) | MAOAMAOBALDH1A1HPGDPOLB | |
| SCHEMBL29846220 | 0.81 | MAOA (0.68) | MAOAMAOBALDH1A1HPGDHSD17B10 | |
| SCHEMBL13708871 | 0.80 | ALDH1A1 (0.54) | MAOAMAOBALDH1A1HPGDHSD17B10 | |
| SCHEMBL27622822 | 0.80 | ADRA1D (0.60) | ALDH1A1HSD17B10POLBL3MBTL1KDM4E |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116606446-A | 4- (pyridine-2-methyleneamino) benzoic acid functionalized NU-1000 and synthetic method thereof | 山西师范大学 | 2023-08-18 | — | — | CN | disclosed |
| CN-111386118-B | Combination pharmaceutical agents as RSV inhibitors | 英安塔制药有限公司 | 2023-05-09 | — | — | CN | disclosed |
| CN-108200760-B | Benzodiazepine derivatives as RSV inhibitors | 英安塔制药有限公司 | 2022-04-01 | — | — | CN | disclosed |