Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 1/20 | 0.42 |
| ▸ | CES1 | P23141 | 1/20 | 0.42 |
| ▸ | KCNQ3 | O43525 | 2/20 | 0.40 |
| ▸ | KCNQ2 | O43526 | 2/20 | 0.40 |
| ▸ | KCNE1 | P15382 | 2/20 | 0.40 |
| ▸ | KCNQ1 | P51787 | 2/20 | 0.40 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.39 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL17420534 | 1.00 | CES2 (0.42) | CES2CES1KCNQ3KCNQ2KCNE1 | |
| SCHEMBL2643972 | 0.85 | TSHR (0.50) | MAPTALDH1A1TSHRSMN1; SMN2LMNA | |
| SCHEMBL3184223 | 0.85 | CES2 (0.60) | CES2CES1KCNQ3KCNQ2MAPT | |
| SCHEMBL6903596 | 0.84 | CA12 (0.56) | MAPTALDH1A1L3MBTL1SMN1; SMN2CYP4F2 | |
| SCHEMBL17466071 | 0.84 | MCL1 (0.44) | MAPTALDH1A1L3MBTL1TSHRSMN1; SMN2 | |
| SCHEMBL17420571 | 0.81 | HPGD (0.46) | MAPTALDH1A1L3MBTL1TSHRSMN1; SMN2 | |
| SCHEMBL17466069 | 0.81 | CES2 (0.44) | CES2CES1MAPTALDH1A1L3MBTL1 | |
| SCHEMBL30628190 | 0.81 | HPGD (0.46) | MAPTALDH1A1L3MBTL1TSHRSMN1; SMN2 | |
| SCHEMBL29082299 | 0.80 | SMN1; SMN2 (0.48) | KCNQ3KCNQ2KCNE1KCNQ1KCNQ5 | |
| SCHEMBL16068855 | 0.80 | HSD17B2 (0.50) | CES2CES1MAPTALDH1A1TSHR |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111170991-B | Antiproliferative compounds and methods of synthesis thereof | 细胞基因公司 | 2023-10-31 | — | — | CN | disclosed |