Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.72 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.72 |
| ▸ | POLB | P06746 | 1/20 | 0.72 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
| ▸ | FDPS | P14324 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.44 |
| ▸ | ALPL | P05186 | 2/20 | 0.42 |
| ▸ | ALPG | P10696 | 2/20 | 0.42 |
| ▸ | ALPI | P09923 | 1/20 | 0.42 |
| ▸ | PLAA | Q9Y263 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | GFER | P55789 | 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 | |
|---|---|---|---|---|
| SCHEMBL27090339 | 0.90 | ALDH1A1 (0.80) | ALDH1A1KMT2APOLBTSHRCA12 | |
| SCHEMBL25009512 | 0.90 | ALDH1A1 (0.80) | ALDH1A1KMT2APOLBTSHRCA12 | |
| SCHEMBL8540879 | 0.88 | ALDH1A1 (0.77) | ALDH1A1KMT2APOLBTSHRCA12 | |
| SCHEMBL25010694 | 0.88 | ALDH1A1 (0.77) | ALDH1A1KMT2APOLBTSHRCA12 | |
| SCHEMBL32685227 | 0.88 | ALDH1A1 (0.77) | ALDH1A1KMT2APOLBTSHRCA12 | |
| SCHEMBL82664 | 0.88 | — | — | |
| Iodide SCHEMBL3474173 | 0.86 | ALDH1A1 (0.74) | ALDH1A1KMT2APOLBTSHRCA12 | |
| Ammonia Solution, Strong SCHEMBL14645160 | 0.86 | ALDH1A1 (0.74) | ALDH1A1KMT2APOLBTSHRCA12 | |
| Iodide SCHEMBL5533691 | 0.86 | ALDH1A1 (0.74) | ALDH1A1KMT2APOLBTSHRCA12 | |
| SCHEMBL665852 | 0.86 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013079514-A1 | SULPHUR-FREE TRANSITION METAL-ISOCYANATE-BASED IONIC LIQUIDS | UNIVERSITÄT ROSTOCK (DE) | 2013-06-06 | — | — | WO | claimed |
| WO-2023010200-A1 | THERAPEUTIC COORDINATION POLYMERS CONTAINING PHARMACEUTICALS FOR DRUG RELEASE APPLICATIONS | UNIVERSITY OF WINDSOR (CA) | 2023-02-09 | — | — | WO | disclosed |
| WO-2013079514-A1 | SULPHUR-FREE TRANSITION METAL-ISOCYANATE-BASED IONIC LIQUIDS | UNIVERSITÄT ROSTOCK (DE) | 2013-06-06 | — | — | WO | disclosed |
| EP-1383497-B1 | CARBONIC ANHYDRASE ACTIVATORS FOR ENHANCING LEARNING AND MEMORY | BRNI NEUROSCIENCES INST (US) | 2008-10-15 | — | — | EP | disclosed |