Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | APP | P05067 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 4/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.59 |
| ▸ | TP53 | P04637 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 5/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.51 |
| ▸ | POLB | P06746 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | KDM4A | O75164 | 1/20 | 0.51 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.49 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL1269440 | 0.98 | APP (0.63) | APPTSHRCYP3A4TP53MAPK1 | |
| SCHEMBL27684582 | 0.97 | LMNA (0.62) | APPTSHRCYP3A4TP53MAPK1 | |
| SCHEMBL5935797 | 0.97 | LMNA (0.62) | APPTSHRCYP3A4TP53MAPK1 | |
| Calcium SCHEMBL2689056 | 0.97 | APP (0.61) | APPTSHRCYP3A4TP53MAPK1 | |
| SCHEMBL29184950 | 0.97 | LMNA (0.62) | APPTSHRCYP3A4TP53MAPK1 | |
| SCHEMBL11148883 | 0.97 | LMNA (0.62) | APPTSHRCYP3A4TP53MAPK1 | |
| SCHEMBL3405851 | 0.94 | APP (0.64) | APPTSHRCYP3A4TP53MAPK1 | |
| Hydrochloric Acid SCHEMBL968484 | 0.92 | APP (0.63) | APPTSHRCYP3A4TP53MAPK1 | |
| Hydrochloric Acid SCHEMBL30779103 | 0.92 | APP (0.63) | APPTSHRCYP3A4TP53MAPK1 | |
| SCHEMBL29204633 | 0.92 | APP (0.56) | APPTSHRCYP3A4TP53MAPK1 |
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-104968643-A | Position-specific asymmetric deuterium enriched catecholamine derivatives and medicaments comprising said compounds | CDRD BEROLINA AB | 2015-10-07 | — | — | CN | claimed |
| CN-104968643-A | Position-specific asymmetric deuterium enriched catecholamine derivatives and medicaments comprising said compounds | CDRD BEROLINA AB | 2015-10-07 | — | — | CN | disclosed |