Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | TTR | P02766 | 1/20 | 0.42 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | CLK2 | P49760 | 1/20 | 0.41 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.41 |
| ▸ | GNE | Q9Y223 | 1/20 | 0.41 |
| ▸ | PRKDC | P78527 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16834258 | 1.00 | ALDH1A1 (0.47) | ALDH1A1KDM4EGAATDP1TSHR | |
| SCHEMBL20055968 | 0.85 | CRBN (0.50) | ALDH1A1KDM4EGAATDP1HPGD | |
| SCHEMBL16834789 | 0.85 | CRBN (0.50) | ALDH1A1KDM4EGAATDP1HPGD | |
| SCHEMBL3469975 | 0.82 | KDM4E (0.46) | KDM4ETDP1TSHRALOX15ACMSD | |
| SCHEMBL31480075 | 0.79 | TTR (0.47) | KDM4ETDP1TSHRALOX15ACMSD | |
| SCHEMBL16834260 | 0.79 | ALDH1A1 (0.44) | ALDH1A1KDM4EGAATDP1TSHR | |
| SCHEMBL20031456 | 0.78 | KDM4E (0.47) | KDM4ETDP1TSHRALOX15ACMSD | |
| SCHEMBL9005458 | 0.77 | PRKCQ (0.62) | KDM4ETDP1TSHRALOX15ACMSD | |
| SCHEMBL14818751 | 0.76 | HTR3E (0.53) | ALDH1A1KDM4EGAATDP1TSHR | |
| SCHEMBL2909203 | 0.76 | ALDH1A1 (0.54) | ALDH1A1KDM4EGAATDP1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3083586-B1 | NOVEL CARBOXAMIDES, METHOD FOR THE PRODUCTION THEREOF, PHARMACEUTICAL PREPARATIONS COMPRISING THEM, AND USE THEREOF FOR PRODUCING MEDICAMENTS | Bayer Pharma AG (DE) | 2018-04-18 | — | — | EP | disclosed |