Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIM1 | P11309 | 1/20 | 0.39 |
| ▸ | CNR1 | P21554 | 2/20 | 0.37 |
| ▸ | CFTR | P13569 | 1/20 | 0.37 |
| ▸ | WDR5 | P61964 | 2/20 | 0.37 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.36 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.36 |
| ▸ | IGF2BP2 | Q9Y6M1 | 1/20 | 0.36 |
| ▸ | KDM5A | P29375 | 1/20 | 0.36 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.36 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 2/20 | 0.36 |
| ▸ | SERPINE1 | P05121 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.35 |
| ▸ | FEN1 | P39748 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL24901197 | 0.73 | — | — | |
| SCHEMBL18534954 | 0.70 | PIM1 (0.43) | PIM1EPHX2IGF2BP2POLBALDH1A1 | |
| SCHEMBL23116724 | 0.65 | P2RX1 (0.44) | PIM1WDR5EPHX2IGF2BP2GAA | |
| SCHEMBL21339744 | 0.65 | KCNK2 (0.47) | EPHX2IGF2BP2KDM5AKDM4CKDM5B | |
| SCHEMBL9004550 | 0.64 | KIF11 (0.50) | WDR5EPHX2NR1H4IGF2BP2KDM5A | |
| SCHEMBL29177400 | 0.64 | EPHX2 (0.47) | PIM1EPHX2IGF2BP2POLBALDH1A1 | |
| Hydrochloric Acid SCHEMBL3962928 | 0.63 | POLB (0.48) | POLBALDH1A1GAAL3MBTL1 | |
| SCHEMBL966871 | 0.63 | RXRB (0.50) | PIM1EPHX2IGF2BP2ALDH1A1PPARA | |
| SCHEMBL27051939 | 0.63 | IGF2BP2 (0.59) | PIM1WDR5EPHX2IGF2BP2KDM5A | |
| SCHEMBL18226248 | 0.63 | CFTR (0.41) | CFTREPHX2IGF2BP2POLBALDH1A1 |
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-2017123860-A1 | SPIROHEPTANE SALICYLAMIDES AND RELATED COMPOUNDS AS INHIBITORS OF ROCK | BRISTOL-MYERS SQUIBB COMPANY (US) | 2017-07-20 | — | — | WO | disclosed |