Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 2/20 | 0.39 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | DGAT2 | Q96PD7 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL11913028 | 1.00 | ALDH1A1 (0.40) | ALDH1A1NPSR1MAPTLMNASMN1; SMN2 | |
| SCHEMBL25160774 | 0.89 | ALDH1A1 (0.38) | ALDH1A1MAPTLMNASMN1; SMN2MEN1 | |
| SCHEMBL14466869 | 0.87 | ALDH1A1 (0.39) | ALDH1A1NPSR1MAPTLMNASMN1; SMN2 | |
| SCHEMBL3891001 | 0.85 | KDM4E (0.48) | ALDH1A1NPSR1MAPTSMN1; SMN2MAPK1 | |
| SCHEMBL15118626 | 0.84 | LMNA (0.41) | ALDH1A1NPSR1MAPTLMNASMN1; SMN2 | |
| SCHEMBL17113764 | 0.84 | POLB (0.49) | ALDH1A1NPSR1MAPTLMNASMN1; SMN2 | |
| SCHEMBL20406093 | 0.84 | KMT2A (0.41) | ALDH1A1NPSR1MAPTLMNASMN1; SMN2 | |
| SCHEMBL161047 | 0.84 | MAPT (0.42) | ALDH1A1NPSR1MAPTLMNASMN1; SMN2 | |
| SCHEMBL14332032 | 0.82 | HTT (0.46) | ALDH1A1NPSR1MAPTLMNASMN1; SMN2 | |
| SCHEMBL17118220 | 0.82 | GABRA1 (0.37) | NPSR1MAPTLMNASMN1; SMN2MAPK1 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116675672-B | Preparation method of antifungal medicine | 北京康立生医药技术开发有限公司 | 2025-04-25 | — | — | CN | disclosed |
| CN-119798219-A | Preparation method of octreonazole | 长治医学院 | 2025-04-11 | — | — | CN | disclosed |
| CN-111170991-B | Antiproliferative compounds and methods of synthesis thereof | 细胞基因公司 | 2023-10-31 | — | — | CN | disclosed |
| CN-116675672-A | New preparation method of antifungal medicine | 北京康立生医药技术开发有限公司 | 2023-09-01 | — | — | CN | disclosed |
| EP-3397629-B1 | METALLOENZYME INHIBITOR COMPOUNDS | NQP 1598 LTD (KY) | 2023-04-19 | — | — | EP | disclosed |
| CN-109970629-B | Process for preparing antifungal compounds | 迈科维亚医药公司 | 2023-04-11 | — | — | CN | disclosed |
| EP-4005638-A1 | HETEROCYCLIC COMPOUND | Takeda Pharmaceutical Company Limited (JP) | 2022-06-01 | — | — | EP | disclosed |