Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.42 |
| ▸ | NLRP3 | Q96P20 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | GLA | P06280 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL19286202 | 0.80 | CA12 (0.38) | GAALMNAALDH1A1KDM4ETP53 | |
| SCHEMBL19286290 | 0.76 | GAA (0.50) | GAAADORA3LMNAALDH1A1AKR1C3 | |
| SCHEMBL19286300 | 0.72 | KDM4E (0.42) | GAAALDH1A1KDM4ETP53MAPT | |
| SCHEMBL19002605 | 0.70 | GAA (0.63) | GAAADORA3LMNAALDH1A1AKR1C3 | |
| SCHEMBL9173395 | 0.68 | GAA (0.63) | GAAADORA3LMNAALDH1A1NLRP3 | |
| SCHEMBL9182658 | 0.67 | LMNA (0.76) | GAALMNAALDH1A1NLRP3KDM4E | |
| SCHEMBL4536235 | 0.67 | GAA (0.64) | GAALMNANLRP3KDM4EHTT | |
| SCHEMBL6879344 | 0.67 | GAA (0.64) | GAALMNAALDH1A1NLRP3KDM4E | |
| SCHEMBL22147829 | 0.67 | TRPA1 (0.30) | — | |
| SCHEMBL19286316 | 0.67 | NR3C1 (0.33) | L3MBTL1 |
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-9744528-B2 | Metallorganocatalysis for asymmetric transformations | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2017-08-29 | — | — | US | disclosed |