Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 2/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CRHBP | P24387 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.39 |
| ▸ | P2RX4 | Q99571 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | NSD2 | O96028 | 1/20 | 0.37 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.37 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.36 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.36 |
| ▸ | F2 | P00734 | 1/20 | 0.36 |
| ▸ | PRSS1 | P07477 | 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 | |
|---|---|---|---|---|
| SCHEMBL28577274 | 0.86 | PKM (0.53) | PKMHPGDLMNAKMT2AMEN1 | |
| SCHEMBL28584713 | 0.83 | HPGD (0.46) | PKMHPGDLMNAKMT2AMEN1 | |
| SCHEMBL28589943 | 0.83 | PKM (0.44) | PKMHPGDLMNAKMT2AMEN1 | |
| SCHEMBL29382261 | 0.82 | PKM (0.49) | PKMHPGDLMNAKMT2AMEN1 | |
| SCHEMBL28586244 | 0.82 | PKM (0.49) | PKMHPGDLMNAKMT2AALDH1A1 | |
| SCHEMBL28595292 | 0.82 | PKM (0.49) | PKMHPGDLMNAKMT2AALDH1A1 | |
| SCHEMBL29382870 | 0.82 | PKM (0.49) | PKMHPGDLMNAKMT2AALDH1A1 | |
| SCHEMBL28586318 | 0.82 | PKM (0.49) | PKMHPGDLMNAKMT2AMEN1 | |
| SCHEMBL28581466 | 0.81 | PKM (0.48) | PKMHPGDLMNAKMT2AMEN1 | |
| SCHEMBL29381728 | 0.81 | PKM (0.48) | PKMHPGDLMNAKMT2AMEN1 |
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-112898296-B | Axial chiral 4-aryl alpha-carboline compound and asymmetric synthesis method thereof | 中国药科大学 | 2022-02-11 | — | — | CN | disclosed |
| CN-112898296-A | Axial chiral 4-aryl alpha-carboline compound and asymmetric synthesis method thereof | 中国药科大学 | 2021-06-04 | — | — | CN | disclosed |