Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HCAR2 | Q8TDS4 | 12/20 | 0.63 |
| ▸ | ATM | Q13315 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 3/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.33 |
| ▸ | EGLN3 | Q9H6Z9 | 1/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16038552 | 0.83 | HCAR2 (0.60) | HCAR2ATMMAPTRAB9ANPSR1 | |
| SCHEMBL16038554 | 0.83 | HCAR2 (0.60) | HCAR2ATMMAPTRAB9ANPSR1 | |
| SCHEMBL2723104 | 0.81 | HCAR2 (0.57) | HCAR2ATMMAPTRAB9ANPSR1 | |
| SCHEMBL8743721 | 0.81 | HCAR2 (0.57) | HCAR2ATMMAPTRAB9ANPSR1 | |
| SCHEMBL2723100 | 0.81 | HCAR2 (0.57) | HCAR2ATMMAPTRAB9ANPSR1 | |
| SCHEMBL11652727 | 0.79 | HCAR2 (0.55) | HCAR2ATMMAPTRAB9ANPSR1 | |
| SCHEMBL11658484 | 0.79 | HCAR2 (0.55) | HCAR2ATMMAPTRAB9ANPSR1 | |
| Propyl Fumarate SCHEMBL322230 | 0.78 | HCAR2 (1.00) | HCAR2ATMMAPTRAB9ANPSR1 | |
| Propyl Fumarate SCHEMBL529074 | 0.78 | HCAR2 (1.00) | HCAR2ATMMAPTRAB9ANPSR1 | |
| Propyl Fumarate SCHEMBL322229 | 0.78 | HCAR2 (1.00) | HCAR2ATMMAPTRAB9ANPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105452213-A | Fumarate prodrugs and their use in the treatment of various diseases | ALKERMES PHARMA IRELAND LTD | 2016-03-30 | — | — | CN | disclosed |