Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 7/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | BRAF | P15056 | 1/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | PIK3C2B | O00750 | 1/20 | 0.42 |
| ▸ | PIK3C2G | O75747 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29230166 | 1.00 | MEN1 (0.47) | MEN1KMT2ANPC1MAPTALDH1A1 | |
| SCHEMBL30944970 | 0.92 | MAPT (0.46) | MEN1KMT2ANPC1MAPTALDH1A1 | |
| SCHEMBL29230203 | 0.92 | MAPT (0.46) | MEN1KMT2ANPC1MAPTALDH1A1 | |
| SCHEMBL30945020 | 0.88 | IGF1R (0.49) | MEN1KMT2ANPC1MAPTALDH1A1 | |
| SCHEMBL29230191 | 0.88 | IGF1R (0.49) | MEN1KMT2ANPC1MAPTALDH1A1 | |
| SCHEMBL29230224 | 0.88 | SLC2A1 (0.54) | MEN1KMT2AMAPTALDH1A1HTT | |
| SCHEMBL30945007 | 0.88 | SLC2A1 (0.54) | MEN1KMT2AMAPTALDH1A1HTT | |
| SCHEMBL30944945 | 0.83 | EGFR (0.49) | MAPT | |
| SCHEMBL29230158 | 0.83 | EGFR (0.49) | MAPT | |
| SCHEMBL30944967 | 0.81 | EGFR (0.46) | MEN1KMT2AMAPTALDH1A1HTT |
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-118146151-A | 4-Trifluoromethyl substituted quinoline and quinazoline compound and application thereof | 贵州省中国科学院天然产物化学重点实验室(贵州医科大学天然产物化学重点实验室) | 2024-06-07 | — | — | CN | disclosed |