Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 4/20 | 0.49 |
| ▸ | IDO1 | P14902 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | NSD2 | O96028 | 2/20 | 0.37 |
| ▸ | GALK1 | P51570 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29382261 | 1.00 | PKM (0.49) | PKMIDO1HPGDKMT2ANSD2 | |
| SCHEMBL28577274 | 0.90 | PKM (0.53) | PKMHPGDKMT2ACA1CA2 | |
| SCHEMBL29382870 | 0.85 | PKM (0.49) | PKMHPGDKMT2ACA1CA2 | |
| SCHEMBL28595292 | 0.85 | PKM (0.49) | PKMHPGDKMT2ACA1CA2 | |
| SCHEMBL29381728 | 0.84 | PKM (0.48) | PKMHPGDKMT2AMAPTMEN1 | |
| SCHEMBL28581466 | 0.84 | PKM (0.48) | PKMHPGDKMT2AMAPTMEN1 | |
| SCHEMBL28589487 | 0.82 | PKM (0.53) | PKMHPGDKMT2ANSD2MAPT | |
| SCHEMBL28586244 | 0.78 | PKM (0.49) | PKMHPGDKMT2AMAPTPOLB | |
| SCHEMBL28581232 | 0.70 | PKM (0.49) | PKMHPGDKMT2AMAPTMEN1 | |
| SCHEMBL31711759 | 0.69 | BRD4 (0.44) | IDO1KMT2AMAPTMEN1ALOX12 |
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 |