Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.48 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.48 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.48 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | HPD | P32754 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 5/20 | 0.41 |
| ▸ | MAOA | P21397 | 4/20 | 0.41 |
| ▸ | DHODH | Q02127 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | CASP3 | P42574 | 1/20 | 0.40 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.40 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.40 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL19914172 | 0.89 | LMNA (0.52) | LMNACYP1A2PTGS1SLC6A2CYP2C19 | |
| SCHEMBL11154487 | 0.74 | L3MBTL1 (0.47) | LMNACYP1A2PTGS1SLC6A2CYP2C19 | |
| SCHEMBL3660167 | 0.74 | TSHR (0.48) | LMNACYP1A2PTGS1SLC6A2CYP2C19 | |
| SCHEMBL11227711 | 0.73 | MAOB (0.39) | LMNACYP1A2PTGS1SLC6A2CYP2C19 | |
| Bromide SCHEMBL11142191 | 0.71 | MAOB (0.37) | LMNACYP1A2PTGS1SLC6A2CYP2C19 | |
| SCHEMBL3278335 | 0.70 | TSHR (0.48) | LMNACYP1A2PTGS1SLC6A2CYP2C19 | |
| SCHEMBL11233344 | 0.69 | MAOB (0.39) | LMNACYP1A2PTGS1SLC6A2CYP2C19 | |
| SCHEMBL6469379 | 0.69 | TSHR (0.52) | LMNACYP1A2PTGS1SLC6A2CYP2C19 | |
| SCHEMBL1061320 | 0.68 | TSHR (0.46) | LMNACYP1A2PTGS1SLC6A2CYP2C19 | |
| Monobenzone SCHEMBL8450838 | 0.66 | LMNA (1.00) | LMNACYP1A2PTGS1SLC6A2CYP2C19 |
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-115850280-B | Preparation method of antiviral drug entecavir intermediate N4 | 南京康立瑞生物科技有限公司 | 2024-07-05 | — | — | CN | disclosed |
| CN-115850280-A | Preparation method of antiviral drug entecavir intermediate N4 | 南京康立瑞生物科技有限公司 | 2023-03-28 | — | — | CN | disclosed |