Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 3/20 | 0.47 |
| ▸ | OPRL1 | P41146 | 3/20 | 0.47 |
| ▸ | ACACA | Q13085 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 4/20 | 0.36 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.36 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.35 |
| ▸ | TNK1 | Q13470 | 2/20 | 0.35 |
| ▸ | TNK2 | Q07912 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.34 |
| ▸ | CRHR1 | P34998 | 1/20 | 0.34 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.34 |
| ▸ | NSD2 | O96028 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP11B1 | P15538 | 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 | |
|---|---|---|---|---|
| SCHEMBL16637430 | 0.79 | OPRM1 (0.44) | OPRM1OPRL1ACACACASP3PARP1 | |
| SCHEMBL16637299 | 0.77 | POLB (0.45) | OPRM1OPRL1ACACAKCNJ1NSD2 | |
| SCHEMBL249165 | 0.66 | PDE3B (0.43) | ADRA1DADRA1AADRA1BKDM4EALDH1A1 | |
| Hydrochloric Acid SCHEMBL6361748 | 0.66 | FPR2 (0.43) | OPRM1OPRL1PARP1PARP2ADRA1D | |
| SCHEMBL31686991 | 0.65 | SLC6A9 (0.45) | ADRA1DADRA1AADRA1BALDH1A1 | |
| SCHEMBL251355 | 0.65 | SLC6A9 (0.45) | OPRM1OPRL1ADRA1DADRA1AADRA1B | |
| SCHEMBL31466783 | 0.65 | ALDH1A1 (0.41) | OPRM1OPRL1KDM4EALDH1A1MAPT | |
| SCHEMBL22914752 | 0.65 | LMNA (0.47) | OPRM1OPRL1ALDH1A1 | |
| SCHEMBL26109284 | 0.65 | ALDH1A1 (0.41) | OPRM1OPRL1KDM4EALDH1A1MAPT | |
| SCHEMBL14637917 | 0.65 | CYP11B1 (0.45) | PARP1PARP2ADRA1DADRA1AADRA1B |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105324382-B | Spirocyclic derivatives, its preparation method and the application of the ketone of 4,5 dihydro-pyrazolos [3,4 c] pyridine 2 | 四川海思科制药有限公司 | 2017-11-10 | — | — | CN | disclosed |
| CN-105324382-A | 4,5-dihydro-pyrazolo[3,4-c]pyridin-2-one spiro derivative, preparation method and use thereof | SICHUAN HAISCO PHARMACEUTICAL CO LTD | 2016-02-10 | — | — | CN | 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 |
| 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 |