Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.46 |
| ▸ | BID | P55957 | 1/20 | 0.45 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.45 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.45 |
| ▸ | BAK1 | Q16611 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.44 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.44 |
| ▸ | MAOA | P21397 | 1/20 | 0.44 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28449931 | 0.88 | SIGMAR1 (0.52) | SIGMAR1BIDBCL2L1MCL1BAK1 | |
| SCHEMBL10917103 | 0.86 | KCNH2 (0.54) | SIGMAR1BIDBCL2L1MCL1BAK1 | |
| SCHEMBL6546189 | 0.84 | KCNH2 (0.48) | SIGMAR1KCNH2L3MBTL1MAOACHRM2 | |
| SCHEMBL9447610 | 0.84 | LIPG (0.50) | BIDBCL2L1MCL1BAK1KCNH2 | |
| SCHEMBL8093946 | 0.83 | HTR2A (0.46) | BCL2L1L3MBTL1LTB4RLTB4R2DRD1 | |
| SCHEMBL5421961 | 0.82 | LIPG (0.53) | BIDBCL2L1MCL1BAK1KCNH2 | |
| SCHEMBL9447628 | 0.82 | LIPG (0.42) | BIDBCL2L1MCL1BAK1KCNH2 | |
| SCHEMBL1452942 | 0.82 | ALDH1A1 (0.41) | LTB4RLTB4R2 | |
| SCHEMBL2049765 | 0.81 | SIGMAR1 (0.44) | SIGMAR1KCNH2HTR1AOPRM1DRD3 | |
| SCHEMBL17473098 | 0.80 | SIGMAR1 (0.40) | SIGMAR1BIDBCL2L1MCL1BAK1 |
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-2017131149-A1 | TETRAHYDRONAPHTHALENE DERIVATIVE | 小野薬品工業株式会社 | 2017-08-03 | — | — | WO | disclosed |