Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CCR6 | P51684 | 1/20 | 0.38 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.38 |
| ▸ | APBA1 | Q02410 | 1/20 | 0.38 |
| ▸ | KCNN4 | O15554 | 2/20 | 0.37 |
| ▸ | KCNA3 | P22001 | 2/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 5/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.36 |
| ▸ | AGTR1 | P30556 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL12787567 | 0.78 | ALDH1A1 (0.39) | HTTMAPTALDH1A1HPGDCCR6 | |
| SCHEMBL6854704 | 0.78 | ALDH1A1 (0.39) | HTTMAPTALDH1A1HPGDCCR6 | |
| SCHEMBL3880938 | 0.78 | ALDH1A1 (0.49) | ALDH1A1KCNN4KCNA3LMNARAB9A | |
| SCHEMBL976147 | 0.77 | LMNA (0.47) | HTTALDH1A1TSHRLMNASMN1; SMN2 | |
| SCHEMBL14032263 | 0.75 | AGTR1 (0.35) | HTTMAPTALDH1A1HPGDCCR6 | |
| SCHEMBL1121488 | 0.74 | LMNA (0.35) | HTTALDH1A1NPSR1LMNAAGTR1 | |
| SCHEMBL5357964 | 0.74 | LMNA (0.35) | HTTMAPTALDH1A1HPGDCCR6 | |
| SCHEMBL3218252 | 0.74 | CYP11B1 (0.33) | HTTMAPTALDH1A1HPGDCCR6 | |
| SCHEMBL2359649 | 0.74 | LMNA (0.35) | HTTALDH1A1CYP11B1CYP11B2NPSR1 | |
| SCHEMBL6577532 | 0.74 | CYP1A2 (0.33) | HTTMAPTALDH1A1HPGDCCR6 |
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-118453591-A | Application of compound as CYP2E1 inhibitor | 苏州灵希生物科技有限公司 | 2024-08-09 | — | — | CN | disclosed |
| CN-118453590-A | Application of compound as CYP2E1 inhibitor | 苏州灵希生物科技有限公司 | 2024-08-09 | — | — | CN | disclosed |
| CN-114099503-B | Application of compound as CYP2E1 inhibitor | 苏州灵希生物科技有限公司 | 2024-07-16 | — | — | CN | disclosed |