Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.41 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.40 |
| ▸ | ACACA | Q13085 | 1/20 | 0.39 |
| ▸ | ELANE | P08246 | 1/20 | 0.39 |
| ▸ | CTSG | P08311 | 1/20 | 0.38 |
| ▸ | CMA1 | P23946 | 1/20 | 0.38 |
| ▸ | PGR | P06401 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.35 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.35 |
| ▸ | NSD2 | O96028 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL16361765 | 0.79 | TP53 (0.44) | POLBOPRM1OPRL1ELANECTSG | |
| SCHEMBL16430910 | 0.78 | ACACA (0.48) | POLBCYP11B2OPRM1OPRL1KCNJ1 | |
| SCHEMBL16637361 | 0.77 | OPRM1 (0.47) | CYP11B2OPRM1OPRL1KCNJ1ACACA | |
| SCHEMBL7422542 | 0.76 | POLB (0.49) | POLBCYP11B2ELANECTSGCMA1 | |
| SCHEMBL16644311 | 0.75 | ALDH1A1 (0.59) | POLBACACAKDM4ECYP2D6 | |
| SCHEMBL16637128 | 0.75 | CYP11B2 (0.40) | POLBCYP11B2OPRM1OPRL1KCNJ1 | |
| SCHEMBL7421728 | 0.73 | ALDH1A1 (0.57) | POLBTP53CYP2D6TSHRSMN1; SMN2 | |
| SCHEMBL21753280 | 0.73 | ACACA (0.56) | POLBKCNJ1ACACACYP2D6TSHR | |
| SCHEMBL4586702 | 0.72 | ALDH1A1 (0.51) | POLBKDM4ETP53TSHRSMN1; SMN2 | |
| SCHEMBL17444273 | 0.72 | OPRL1 (0.66) | OPRM1OPRL1KCNJ1 |
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 |