Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | P2RY6 | Q15077 | 1/20 | 0.34 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.33 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.33 |
| ▸ | NOS3 | P29474 | 1/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | NOS2 | P35228 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 3/20 | 0.32 |
| ▸ | DRD3 | P35462 | 3/20 | 0.32 |
| ▸ | PNMT | P11086 | 1/20 | 0.32 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.32 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.30 |
| ▸ | CHRNG | P07510 | 1/20 | 0.30 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.30 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.30 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL29185096 | 0.86 | CA12 (0.38) | CA12CA9IMPDH2IMPDH1NOS3 | |
| SCHEMBL6253304 | 0.72 | AHR (0.50) | CA12CA9 | |
| SCHEMBL29765229 | 0.72 | CA12 (0.44) | CA12CA9 | |
| SCHEMBL18264369 | 0.72 | AHR (0.45) | PTGS2DRD2DRD3 | |
| SCHEMBL20511110 | 0.70 | TRPA1 (0.39) | IMPDH2IMPDH1 | |
| SCHEMBL30860504 | 0.68 | CA12 (0.49) | CA12CA9PTGS2P2RY6CYP2A6 | |
| SCHEMBL6369121 | 0.68 | CA12 (0.49) | CA12CA9PTGS2P2RY6CYP2A6 | |
| SCHEMBL5807597 | 0.68 | CA12 (0.49) | CA12CA9PTGS2P2RY6IMPDH2 | |
| SCHEMBL11619301 | 0.68 | CA12 (0.47) | CA12CA9IMPDH2IMPDH1NOS3 | |
| SCHEMBL30514053 | 0.67 | CA12 (0.40) | CA12CA9PTGS2IMPDH2IMPDH1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102421784-B | As the 7-cycloalkyl amino quinolone of GSK-3 inhibitor | KYORIN PHARMACEUTICAL CO.,LTD. (JP) | 2015-09-30 | — | — | CN | disclosed |
| EP-2748157-A1 | METHOD FOR PRODUCING TETRAZOLE-SUBSTITUTED ANTHRANILIC ACID DIAMIDE DERIVATIVES BY REACTING BENZOXAZINONES WITH AMINES | Bayer Intellectual Property GmbH (DE) | 2014-07-02 | — | — | EP | disclosed |
| WO-2013030100-A1 | METHOD FOR PRODUCING TETRAZOLE-SUBSTITUTED ANTHRANILIC ACID DIAMIDE DERIVATIVES BY REACTING BENZOXAZINONES WITH AMINES | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2013-03-07 | — | — | WO | disclosed |
| CN-102421784-A | 7-cycloalkylaminoquinolones as gsk-3 inhibitors | KYORIN SEIYAKU KK | 2012-04-18 | — | — | CN | disclosed |
| EP-2203459-A1 | SPIROCYCLIC AMINOQUINOLONES AS GSK-3 INHIBITORS | Activx Biosciences, Inc. (US) | 2010-07-07 | — | — | EP | disclosed |
| WO-2009035684-A1 | SPIROCYCLIC AMINOQUINOLONES AS GSK-3 INHIBITORS | ACTIVX BIOSCIENCES, INC. (US) | 2009-03-19 | — | — | WO | disclosed |