Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 3/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.37 |
| ▸ | ITGB3 | P05106 | 4/20 | 0.37 |
| ▸ | ITGA2B | P08514 | 4/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL16644311 | 0.82 | ALDH1A1 (0.59) | ALDH1A1HPGDCYP1A2CYP2D6ITGB3 | |
| SCHEMBL16637238 | 0.77 | L3MBTL1 (0.42) | OPRM1OPRL1ALDH1A1HPGDL3MBTL1 | |
| SCHEMBL16361765 | 0.77 | TP53 (0.44) | OPRM1OPRL1SMN1; SMN2GAAMAPT | |
| SCHEMBL16637490 | 0.76 | HPGD (0.67) | ALDH1A1HPGDSMN1; SMN2GAA | |
| SCHEMBL16361938 | 0.74 | SLC6A2 (0.38) | ALDH1A1SMN1; SMN2ITGB3ITGA2BRAB9A | |
| SCHEMBL16637299 | 0.71 | POLB (0.45) | OPRM1OPRL1SMN1; SMN2CYP2D6 | |
| SCHEMBL25315488 | 0.67 | ACACB (0.46) | SMN1; SMN2ITGB3ITGA2BMAPT | |
| SCHEMBL1004649 | 0.67 | ALDH1A1 (0.73) | ALDH1A1HPGDSMN1; SMN2CYP1A2CYP2D6 | |
| SCHEMBL13664713 | 0.66 | SLC6A2 (0.57) | OPRM1OPRL1ALDH1A1L3MBTL1ITGB3 | |
| SCHEMBL738643 | 0.65 | TSHR (0.54) | ALDH1A1HPGDSMN1; SMN2CYP1A2CYP2D6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015051713-A1 | 4,5-DIHYDRO-PYRAZOLO[3,4-C]PYRIDIN-2-ONE SPIRO DERIVATIVE, PREPARATION METHOD AND USE THEREOF | 四川海思科制药有限公司 | 2015-04-16 | — | — | WO | disclosed |
| WO-2015051713-A1 | 4,5-DIHYDRO-PYRAZOLO[3,4-C]PYRIDIN-2-ONE SPIRO DERIVATIVE, PREPARATION METHOD AND USE THEREOF | 四川海思科制药有限公司 | 2015-04-16 | — | — | WO | disclosed |