Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB4 | P30926 | 4/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 4/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | TOP2A | P11388 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | MITF | O75030 | 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 | |
|---|---|---|---|---|
| SCHEMBL26292864 | 0.85 | CHRNB4 (0.40) | CHRNB4CHRNA3CHRNB2CHRNA4MAPT | |
| SCHEMBL7920992 | 0.78 | HCRTR2 (0.45) | CHRNB2CHRNA4MAPTGAACA1 | |
| SCHEMBL24075137 | 0.77 | HCRTR2 (0.50) | CA1CA2HTR1AHTR2CCYP19A1 | |
| SCHEMBL22624396 | 0.77 | MAPK9 (0.33) | KDM4ELMNATOP2AALDH1A1MAPK1 | |
| SCHEMBL18512270 | 0.77 | HCRTR2 (0.50) | CA1CA2HTR1AHTR2CCYP19A1 | |
| SCHEMBL24075753 | 0.77 | HCRTR2 (0.50) | CA1CA2HTR1AHTR2CCYP19A1 | |
| SCHEMBL16649032 | 0.77 | DRD3 (0.49) | CHRNB4CHRNA3CHRNB2CHRNA4KDM4E | |
| SCHEMBL507239 | 0.77 | HTR2A (0.39) | KDM4ETOP2AALDH1A1MAPK1HTR1A | |
| SCHEMBL24075132 | 0.74 | HCRTR1 (0.48) | MAPTSMN1; SMN2MAPK1MEN1KMT2A | |
| SCHEMBL13714962 | 0.74 | CYP19A1 (0.44) | MAPTNPC1RAB9AALDH1A1TDP1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105026392-B | 4,5-dihydro-pyrazolo [3, 4-c] pyrid-2-ones, preparation method and application thereof | 四川海思科制药有限公司 | 2017-05-10 | — | — | CN | disclosed |
| WO-2014169845-A2 | 4,5-DIHYDRO-PYRAZOLO [3, 4-C] PYRID-2-ONES, PREPARATION METHOD AND APPLICATION THEREOF | 四川海思科制药有限公司 (CN) | 2014-10-23 | — | — | WO | disclosed |
| CN-104109165-A | 4,5-dihydro-pyrazolo[3,4-c]pyrid-2-one derivatives, and preparation method and application thereof | SICHUAN HAISCO PHARMACEUTICAL CO LTD | 2014-10-22 | — | — | CN | disclosed |