Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P4HTM | Q9NXG6 | 10/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.40 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.40 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.40 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.39 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.39 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.39 |
| ▸ | PI4KA | P42356 | 1/20 | 0.39 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.39 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL14918550 | 0.84 | P4HTM (0.42) | P4HTMNPC1ALDH1A1GAARAB9A | |
| SCHEMBL19156381 | 0.83 | P4HTM (0.42) | P4HTMNPC1ALDH1A1GAARAB9A | |
| SCHEMBL22341854 | 0.82 | P4HTM (0.44) | P4HTMNPC1ALDH1A1GAARAB9A | |
| SCHEMBL22341873 | 0.81 | P4HTM (0.46) | P4HTMHDAC3HDAC4HDAC1HDAC8 | |
| SCHEMBL17729302 | 0.81 | P4HTM (0.54) | P4HTMNPC1ALDH1A1GAARAB9A | |
| SCHEMBL20934803 | 0.79 | NAMPT (0.47) | P4HTMHDAC3HDAC8ADORA2A | |
| SCHEMBL25041234 | 0.79 | ADRA2A (0.44) | P4HTMSMN1; SMN2HDAC3HDAC4HDAC1 | |
| SCHEMBL22227949 | 0.78 | P4HTM (0.55) | P4HTMNPC1ALDH1A1GAARAB9A | |
| SCHEMBL28941020 | 0.77 | HDAC1 (0.37) | P4HTMNPC1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL28292613 | 0.77 | NAMPT (0.55) | P4HTMNPC1ALDH1A1GAARAB9A |
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-109689647-B | Bicyclic heteroaryl substituted compounds | 百时美施贵宝公司 | 2023-01-20 | — | — | CN | claimed |
| CN-109689647-B | Bicyclic heteroaryl substituted compounds | 百时美施贵宝公司 | 2023-01-20 | — | — | CN | disclosed |
| CN-109689647-A | The compound that bicyclic heteroaryl replaces | 百时美施贵宝公司 | 2019-04-26 | — | — | CN | disclosed |