Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL15672856 | 0.90 | CA12 (0.50) | CA12CA9CA2MCOLN3KDM4E | |
| SCHEMBL13762630 | 0.90 | CA12 (0.50) | CA12CA9CA2MCOLN3ALDH1A1 | |
| SCHEMBL8910873 | 0.89 | CA12 (0.43) | CA12CA9CA2MCOLN3ALDH1A1 | |
| SCHEMBL3766593 | 0.82 | CA12 (0.44) | CA12CA9CA2MCOLN3KDM4E | |
| SCHEMBL15672926 | 0.81 | CA12 (0.50) | CA12CA9CA2MCOLN3KDM4E | |
| Hydrochloric Acid SCHEMBL21633659 | 0.81 | CA12 (0.43) | CA12CA9CA2MCOLN3KDM4E | |
| SCHEMBL17333692 | 0.78 | ESR1 (0.51) | ALDH1A1MAPK1HIF1AEPAS1ESR1 | |
| SCHEMBL17141412 | 0.78 | ESR1 (0.38) | CA12CA9CA2ALDH1A1MAPK1 | |
| SCHEMBL21765905 | 0.78 | MAPT (0.45) | CA12CA9CA2MCOLN3ALDH1A1 | |
| SCHEMBL16327176 | 0.78 | CA12 (0.47) | CA12CA9CA2MCOLN3MAPK1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7214715-B2 | Compounds to treat Alzheimer's disease | PHARMACIA & UPJOHN (US) | 2007-05-08 | — | — | US | disclosed |