Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MGLL | Q99685 | 1/20 | 0.37 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.36 |
| ▸ | TRPM2 | O94759 | 1/20 | 0.36 |
| ▸ | ATM | Q13315 | 2/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | TACR1 | P25103 | 1/20 | 0.35 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | UBE2M | P61081 | 1/20 | 0.33 |
| ▸ | DCUN1D1 | Q96GG9 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL1709490 | 1.00 | ALDH1A1 (0.38) | ALDH1A1KDM4EMGLLCYP11B1CYP11B2 | |
| SCHEMBL1709509 | 0.86 | DPEP1 (0.36) | MGLLMCHR1TACR1HSD11B1 | |
| SCHEMBL1709462 | 0.86 | DPEP1 (0.36) | MGLLMCHR1TACR1HSD11B1 | |
| SCHEMBL1709374 | 0.84 | KMT2A (0.39) | ALDH1A1MGLLMAPTTDP1 | |
| SCHEMBL10032831 | 0.81 | TACR1 (0.36) | MGLLMCHR1TACR1HSD11B1 | |
| SCHEMBL10032832 | 0.81 | TACR1 (0.36) | MGLLMCHR1TACR1HSD11B1 | |
| SCHEMBL6917708 | 0.81 | ALDH1A1 (0.39) | ALDH1A1KDM4EMGLLCYP11B1CYP11B2 | |
| SCHEMBL6918161 | 0.81 | ALDH1A1 (0.39) | ALDH1A1KDM4EMGLLCYP11B1CYP11B2 | |
| SCHEMBL1709405 | 0.81 | TACR1 (0.38) | MGLLMCHR1TACR1HSD11B1 | |
| SCHEMBL1709393 | 0.80 | KDM4E (0.38) | ALDH1A1KDM4EMGLLCYP11B1CYP11B2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012046771-A1 | CYCLOALKANE COMPOUND | アステラス製薬株式会社 (JP) | 2012-04-12 | — | — | WO | disclosed |