Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.62 |
| ▸ | TSHR | P16473 | 1/20 | 0.62 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.62 |
| ▸ | PDE4A | P27815 | 1/20 | 0.58 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.58 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.58 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.58 |
| ▸ | MEN1 | O00255 | 4/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.56 |
| ▸ | CA2 | P00918 | 4/20 | 0.56 |
| ▸ | CA1 | P00915 | 3/20 | 0.56 |
| ▸ | HTT | P42858 | 2/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | USP2 | O75604 | 1/20 | 0.47 |
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL4953490 | 1.00 | ALDH1A1 (0.62) | ALDH1A1SMN1; SMN2MAPK1TSHRNPSR1 | |
| SCHEMBL4948782 | 0.92 | CYP1A2 (0.67) | ALDH1A1SMN1; SMN2MAPK1TSHRNPSR1 | |
| SCHEMBL4948774 | 0.92 | CYP1A2 (0.67) | ALDH1A1SMN1; SMN2MAPK1TSHRNPSR1 | |
| SCHEMBL8404960 | 0.84 | ALDH1A1 (0.69) | ALDH1A1SMN1; SMN2MAPK1TSHRNPSR1 | |
| SCHEMBL4953376 | 0.84 | KMT2A (0.54) | ALDH1A1SMN1; SMN2MAPK1TSHRNPSR1 | |
| SCHEMBL4953368 | 0.84 | KMT2A (0.54) | ALDH1A1SMN1; SMN2MAPK1TSHRNPSR1 | |
| SCHEMBL3462136 | 0.83 | TUBB4A (0.55) | ALDH1A1SMN1; SMN2MAPK1TSHRNPSR1 | |
| SCHEMBL29019304 | 0.82 | ALDH1A1 (0.67) | ALDH1A1SMN1; SMN2MAPK1TSHRNPSR1 | |
| SCHEMBL5469106 | 0.81 | ALDH1A1 (0.65) | ALDH1A1SMN1; SMN2MAPK1TSHRNPSR1 | |
| SCHEMBL4954511 | 0.81 | PDE4A (0.58) | ALDH1A1SMN1; SMN2MAPK1TSHRNPSR1 |
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 |