Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PSMB5 | P28074 | 1/20 | 0.47 |
| ▸ | SGK1 | O00141 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 4/20 | 0.40 |
| ▸ | GSK3A | P49840 | 1/20 | 0.39 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | CLK1 | P49759 | 2/20 | 0.37 |
| ▸ | CDC7 | O00311 | 1/20 | 0.37 |
| ▸ | DBF4 | Q9UBU7 | 1/20 | 0.37 |
| ▸ | AXL | P30530 | 1/20 | 0.37 |
| ▸ | CDK8 | P49336 | 1/20 | 0.37 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.37 |
| ▸ | PARP1 | P09874 | 1/20 | 0.37 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.35 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.35 |
| ▸ | DPP4 | P27487 | 1/20 | 0.35 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.35 |
| ▸ | MAPK10 | P53779 | 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 | |
|---|---|---|---|---|
| SCHEMBL28028770 | 0.80 | PSMB5 (0.42) | PSMB5SGK1GSK3BGSK3AGRIN2B | |
| SCHEMBL28067774 | 0.71 | HTT (0.56) | MAPTKDM4ELOXL2 | |
| SCHEMBL318563 | 0.69 | MAP4K4 (0.50) | SGK1GSK3BGSK3AMAPTCASP1 | |
| SCHEMBL3784027 | 0.69 | TAAR1 (0.48) | MAPTKDM4EDPP4PRMT5 | |
| SCHEMBL2571211 | 0.69 | TAAR1 (0.48) | MAPTKDM4EDPP4 | |
| SCHEMBL13886860 | 0.68 | PSMB5 (0.68) | PSMB5GSK3BGSK3AAXLCDK8 | |
| SCHEMBL24659982 | 0.67 | KDM4E (0.49) | PSMB5GSK3BGSK3AMAPTCASP1 | |
| SCHEMBL3914647 | 0.66 | CYP1A2 (0.59) | GRIN2BMAPTLOXL2DPP4 | |
| SCHEMBL15785404 | 0.65 | MAP4K4 (0.71) | PSMB5GSK3BGSK3AMAPTCASP1 | |
| SCHEMBL29361094 | 0.65 | MAP4K4 (0.71) | PSMB5GSK3BGSK3AMAPTCASP1 |
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-105601565-B | A kind of preparation method of the polyisocyanates of the biuret-containing structure of stable storage | 万华化学集团股份有限公司 | 2018-05-15 | — | — | CN | claimed |
| CN-105601565-B | A kind of preparation method of the polyisocyanates of the biuret-containing structure of stable storage | 万华化学集团股份有限公司 | 2018-05-15 | — | — | CN | disclosed |
| CN-105601565-A | Method for preparing polyisocyanate containing biuret structure with stable storage | WANHUA CHEMICAL GROUP CO LTD | 2016-05-25 | — | — | CN | disclosed |