Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 8/20 | 0.41 |
| ▸ | CA2 | P00918 | 8/20 | 0.41 |
| ▸ | CA9 | Q16790 | 6/20 | 0.41 |
| ▸ | CA12 | O43570 | 5/20 | 0.41 |
| ▸ | CA4 | P22748 | 3/20 | 0.41 |
| ▸ | CA6 | P23280 | 2/20 | 0.41 |
| ▸ | CA7 | P43166 | 2/20 | 0.41 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.41 |
| ▸ | CA3 | P07451 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.41 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.41 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8634801 | 0.84 | ATM (0.46) | ATMALDH1A1SMN1; SMN2MEN1MAPT | |
| SCHEMBL28143996 | 0.82 | ATM (0.47) | ATMALDH1A1SMN1; SMN2MEN1MAPT | |
| SCHEMBL8503387 | 0.72 | PTGS2 (0.44) | ATMALDH1A1SMN1; SMN2CA1CA2 | |
| SCHEMBL7210655 | 0.72 | PTGS2 (0.76) | CA1CA2CA9CA12CA4 | |
| SCHEMBL7212148 | 0.68 | PTGS2 (0.76) | ALDH1A1CA1CA2CA9CA12 | |
| SCHEMBL6595380 | 0.68 | ALDH1A1 (0.39) | ALDH1A1CA1CA2CA9CA12 | |
| SCHEMBL4321937 | 0.68 | CA2 (0.45) | ALDH1A1SMN1; SMN2CA1CA2CA9 | |
| SCHEMBL5323928 | 0.68 | FDPS (0.42) | ALDH1A1SMN1; SMN2CA1CA2CA9 | |
| SCHEMBL7992092 | 0.68 | CA1 (0.42) | CA1CA2CA9CA12CA4 | |
| SCHEMBL8140854 | 0.67 | ATM (0.48) | ATMALDH1A1SMN1; SMN2MEN1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-2739617-A1 | SPIROCYCLIC MOLECULES AS PROTEIN KINASE INHIBITORS | Nanjing Allgen Pharma Co. Ltd. (CN) | 2014-06-11 | — | — | EP | disclosed |
| WO-2013013308-A1 | SPIROCYCLIC MOLECULES AS PROTEIN KINASE INHIBITORS | BETA PHARMA CANADA INC. (CA) | 2013-01-31 | — | — | WO | disclosed |
| WO-2010083199-A1 | BENZTHIAZOLE INHIBITORS OF POLY(ADP-RIBOSE)POLYMERASE | ABBOTT LABORATORIES (US) | 2010-07-22 | — | — | WO | disclosed |
| EP-2195298-A1 | CRYSTALLINE INDAZOLE-DERIVED CHEMOTHEREPEUTIC | Abbott Laboratories (US) | 2010-06-16 | — | — | EP | disclosed |
| WO-2010030739-A1 | POLYETHYLENE GLYCOL LIPID CONJUGATES AND USES THEREOF | ABBOTT LABORATORIES (US) | 2010-03-18 | — | — | WO | disclosed |
| WO-2009052226-A1 | CRYSTALLINE INDAZOLE-DERIVED CHEMOTHEREPEUTIC | ABBOTT LABORATORIES (US) | 2009-04-23 | — | — | WO | disclosed |