Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 8/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.47 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.47 |
| ▸ | USP2 | O75604 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 8/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.46 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HBB | P68871 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CSNK2A1 | P68400 | 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 | |
|---|---|---|---|---|
| SCHEMBL6953674 | 0.80 | HSP90AA1 (0.55) | CYP3A4CYP1A2HSD17B10CLK4USP2 | |
| SCHEMBL3503323 | 0.77 | HSP90AA1 (0.45) | CYP3A4CYP1A2HSD17B10CLK4USP2 | |
| SCHEMBL3504880 | 0.77 | ALDH1A1 (0.56) | CYP3A4CYP1A2HSD17B10CLK4USP2 | |
| SCHEMBL8184622 | 0.76 | CYP3A4 (0.45) | CYP3A4CYP1A2HSD17B10CLK4USP2 | |
| SCHEMBL3508765 | 0.75 | ALDH1A1 (0.43) | ALDH1A1LMNAALOX15TP53TSHR | |
| SCHEMBL3504561 | 0.74 | ALDH1A1 (0.46) | CYP3A4CYP1A2HSD17B10CLK4USP2 | |
| SCHEMBL3505036 | 0.74 | ALDH1A1 (0.58) | CYP3A4CYP1A2HSD17B10CLK4USP2 | |
| SCHEMBL3510105 | 0.73 | ALDH1A1 (0.50) | HSD17B10USP2ALDH1A1LMNAALOX15 | |
| SCHEMBL3505581 | 0.73 | HSP90AA1 (0.50) | CYP3A4CYP1A2HSD17B10CLK4USP2 | |
| SCHEMBL9085767 | 0.72 | NR1I3 (0.46) | CYP3A4CYP1A2HSD17B10CLK4USP2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6046203-A | USEFUL FOR THE TREATMENT OF VARIOUS MEMORY DYSFUNCTIONS CHARACTERIZED BY A DECREASED CHOLINERGIC FUNCTION SUCH AS ALZHEIMER'S DISEASE; ALSO INHIBIT MONOAMINE OXIDASE AND HENCE ARE USEFUL AS ANTIDEPRESSANTS | AVENTIS PHARMACEUTICALS INC. (US) | 2000-04-04 | — | — | US | disclosed |