Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARA | Q07869 | 2/20 | 0.46 |
| ▸ | CTSS | P25774 | 1/20 | 0.44 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 3/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.40 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.40 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.40 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.39 |
| ▸ | PRKCA | P17252 | 1/20 | 0.39 |
| ▸ | PRKCD | Q05655 | 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 | |
|---|---|---|---|---|
| SCHEMBL28763879 | 1.00 | PPARA (0.46) | PPARACTSSPPARGCA1SCN9A | |
| SCHEMBL27580044 | 0.88 | PPARA (0.46) | PPARACTSSPPARGCA1SCN9A | |
| SCHEMBL15311168 | 0.83 | CTSK (0.49) | CTSSCA1SCN9ARAB9ANPC1 | |
| SCHEMBL27794800 | 0.83 | CTSK (0.49) | CTSSCA1SCN9ARAB9ANPC1 | |
| SCHEMBL14716956 | 0.83 | CTSK (0.49) | CTSSCA1SCN9ARAB9ANPC1 | |
| SCHEMBL10941766 | 0.82 | SLC1A1 (0.44) | PPARACA1APOBEC3AAPOBEC3GSLC1A1 | |
| SCHEMBL27765430 | 0.81 | NPC1 (0.48) | CTSSSCN9ARAB9ANPC1MAPT | |
| SCHEMBL28579006 | 0.81 | NPC1 (0.48) | CTSSSCN9ARAB9ANPC1MAPT | |
| SCHEMBL17044689 | 0.80 | SLC1A1 (0.48) | CA1APOBEC3AAPOBEC3GSLC1A1CA2 | |
| SCHEMBL27826715 | 0.80 | CTSS (0.50) | PPARACTSSPPARG |
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 |
|---|---|---|---|---|---|---|---|
| CN-115916790-A | Pyrido [2,3-b ] [1,4] oxazines or tetrahydropyrido [2,3-b ] [1,4] oxazepines as IAP antagonists | 百济神州有限公司 | 2023-04-04 | — | — | CN | disclosed |
| CN-112469725-A | Penicillin binding protein inhibitors | 维纳拓尔斯制药公司 | 2021-03-09 | — | — | CN | disclosed |