Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | IDH1 | O75874 | 9/20 | 0.41 |
| ▸ | MME | P08473 | 6/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | ACE | P12821 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21905591 | 0.86 | IDH1 (0.40) | IDH1KDM4E | |
| SCHEMBL29550106 | 0.84 | MAPT (0.56) | GAAMAPTIDH1MMEKDM4E | |
| SCHEMBL16464958 | 0.84 | MAPT (0.56) | GAAMAPTIDH1MMEKDM4E | |
| SCHEMBL16464959 | 0.84 | MAPT (0.56) | GAAMAPTIDH1MMEKDM4E | |
| SCHEMBL2608547 | 0.84 | MAPT (0.56) | GAAMAPTIDH1MMEKDM4E | |
| Hydrochloric Acid SCHEMBL18103843 | 0.83 | MAPT (0.54) | GAAMAPTIDH1MMEKDM4E | |
| SCHEMBL15529909 | 0.77 | IDH1 (0.39) | IDH1 | |
| Trifluoroacetic Acid SCHEMBL18103811 | 0.77 | MAPT (0.48) | GAAMAPTIDH1MMEKDM4E | |
| SCHEMBL21358576 | 0.75 | SLC40A1 (0.44) | MAPTKDM4EALDH1A1 | |
| SCHEMBL483331 | 0.73 | HTR2A (0.37) | IDH1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110139864-B | Pyrrole amides as alpha V integrin inhibitors | 百时美施贵宝公司 | 2022-08-23 | — | — | CN | disclosed |
| CN-111433207-A | As αVPyrrolopyrazine derivatives of integrin inhibitors | 百时美施贵宝公司 | 2020-07-17 | — | — | CN | disclosed |
| EP-2501693-A1 | NOVEL HETEROCYCLIC ACRYLAMIDES AND THEIR USE AS PHARMACEUTICALS | FAB Pharma SAS (FR) | 2012-09-26 | — | — | EP | disclosed |
| WO-2011061214-A1 | NOVEL HETEROCYCLIC ACRYLAMIDES AND THEIR USE AS PHARMACEUTICALS | FAB PHARMA SAS (FR) | 2011-05-26 | — | — | WO | disclosed |
| WO-2007016610-A2 | ANTIBACTERIAL AGENTS | GLAXO GROUP LIMITED (GB) | 2007-02-08 | — | — | WO | disclosed |