Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 4/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28489904 | 0.88 | TAAR1 (0.49) | ALDH1A1KMT2AMEN1TSHRSMN1; SMN2 | |
| SCHEMBL28498694 | 0.84 | CYP19A1 (0.45) | ALDH1A1KMT2ALMNAHSD17B10POLB | |
| SCHEMBL28497515 | 0.84 | LMNA (0.48) | ALDH1A1KMT2ALMNASMN1; SMN2HSD17B10 | |
| SCHEMBL28487986 | 0.84 | CA1 (0.50) | ALDH1A1KMT2AMEN1LMNASMN1; SMN2 | |
| SCHEMBL28498338 | 0.81 | ALDH1A1 (0.65) | ALDH1A1KMT2AMEN1LMNASMN1; SMN2 | |
| SCHEMBL28498453 | 0.80 | NQO2 (0.40) | ALDH1A1KMT2AMEN1HSD17B10POLB | |
| SCHEMBL23451396 | 0.76 | ALDH1A1 (0.60) | ALDH1A1KMT2AMEN1LMNAMAPT | |
| SCHEMBL19392334 | 0.73 | KMT2A (0.75) | ALDH1A1KMT2AMEN1LMNATSHR | |
| SCHEMBL17974015 | 0.73 | ALDH1A1 (0.64) | ALDH1A1KMT2AMEN1LMNATSHR | |
| SCHEMBL28489208 | 0.72 | PDE4B (0.54) | ALDH1A1KMT2AMEN1LMNATSHR |
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-112110932-B | Method for synthesizing phthalide tetrahydroisoquinoline compound by tandem cyclization strategy | 沈阳药科大学 | 2021-12-28 | — | — | CN | disclosed |
| CN-112110932-A | Method for synthesizing phthalide tetrahydroisoquinoline compound by tandem cyclization strategy | 沈阳药科大学 | 2020-12-22 | — | — | CN | disclosed |