Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | CA2 | P00918 | 5/20 | 0.56 |
| ▸ | CA12 | O43570 | 4/20 | 0.56 |
| ▸ | CA9 | Q16790 | 4/20 | 0.56 |
| ▸ | MMP2 | P08253 | 4/20 | 0.56 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.56 |
| ▸ | MMP1 | P03956 | 2/20 | 0.56 |
| ▸ | MMP9 | P14780 | 2/20 | 0.56 |
| ▸ | MMP13 | P45452 | 2/20 | 0.56 |
| ▸ | MMP3 | P08254 | 1/20 | 0.56 |
| ▸ | MMP7 | P09237 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | CA1 | P00915 | 3/20 | 0.54 |
| ▸ | CA3 | P07451 | 1/20 | 0.54 |
| ▸ | CA4 | P22748 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL4950680 | 1.00 | ALDH1A1 (0.62) | ALDH1A1POLBCA2CA12CA9 | |
| SCHEMBL6923978 | 0.84 | CA2 (0.59) | ALDH1A1CA2CA12CA9MMP2 | |
| SCHEMBL3759433 | 0.84 | ALDH1A1 (0.73) | ALDH1A1POLBCA2CA12CA9 | |
| SCHEMBL28426090 | 0.84 | ALDH1A1 (0.73) | ALDH1A1POLBCA2CA12CA9 | |
| SCHEMBL7025505 | 0.83 | GFER (0.54) | ALDH1A1POLBCA2CA12CA9 | |
| SCHEMBL25185018 | 0.83 | CNR1 (0.57) | ALDH1A1POLBCA2CA12CA9 | |
| SCHEMBL25185020 | 0.83 | CNR1 (0.57) | ALDH1A1POLBCA2CA12CA9 | |
| Hydrochloric Acid SCHEMBL8123779 | 0.82 | ALDH1A1 (0.71) | ALDH1A1POLBCA2CA12CA9 | |
| SCHEMBL31477053 | 0.81 | MMP9 (0.69) | CA2CA12CA9MMP2CA14 | |
| SCHEMBL15658723 | 0.81 | CRHBP (0.61) | ALDH1A1POLBKMT2ALMNAMEN1 |
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-7385064-B1 | Catalysts for use in enantioselective synthesis | THE RESEARCH FOUNDATION OF STATE UNIVERSITY OF NEW YORK | 2008-06-10 | — | — | US | disclosed |