Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2B | Q13224 | 3/20 | 0.50 |
| ▸ | MC4R | P32245 | 1/20 | 0.47 |
| ▸ | BCHE | P06276 | 2/20 | 0.46 |
| ▸ | ACHE | P22303 | 2/20 | 0.46 |
| ▸ | BACE1 | P56817 | 2/20 | 0.46 |
| ▸ | FYN | P06241 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | KDM1A | O60341 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.44 |
| ▸ | DPP9 | Q86TI2 | 2/20 | 0.44 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.44 |
| ▸ | RB1 | P06400 | 1/20 | 0.43 |
| ▸ | HRH2 | P25021 | 1/20 | 0.42 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.42 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.42 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.42 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL12323279 | 0.89 | GRIN2B (0.47) | GRIN2BBCHEACHEBACE1FYN | |
| SCHEMBL8186106 | 0.85 | GRIN2B (0.56) | GRIN2BMC4RBCHEACHEBACE1 | |
| SCHEMBL4574649 | 0.81 | CARM1 (0.50) | CARM1PRMT6 | |
| SCHEMBL23948575 | 0.79 | GRIN2B (0.50) | GRIN2BBCHEACHEBACE1FYN | |
| SCHEMBL14504603 | 0.78 | GRIN2B (0.46) | GRIN2BMC4RBCHEACHEBACE1 | |
| SCHEMBL28159653 | 0.78 | GRIN2B (0.46) | GRIN2BMC4RBCHEACHEBACE1 | |
| SCHEMBL28404369 | 0.78 | GRIN2B (0.46) | GRIN2BMC4RBCHEACHEBACE1 | |
| SCHEMBL7521305 | 0.77 | GRIN2B (0.49) | GRIN2BBCHEACHEBACE1FYN | |
| SCHEMBL7161614 | 0.77 | GRIN2B (0.49) | GRIN2BBCHEACHEBACE1FYN | |
| SCHEMBL6844239 | 0.77 | GRIN2B (0.49) | GRIN2BBCHEACHEBACE1FYN |
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-2012019430-A1 | PHTHALAZINONE DERIVATIVE, AND PREPARATION METHOD AND PHARMACEUTICAL USE THEREOF | 上海恒瑞医药有限公司 (CN) | 2012-02-16 | — | — | WO | disclosed |