Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | USP2 | O75604 | 4/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.35 |
| ▸ | CASP1 | P29466 | 4/20 | 0.35 |
| ▸ | CASP7 | P55210 | 4/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.34 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | HBB | P68871 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10069604 | 0.91 | ERCC5 (0.38) | ALDH1A1USP2CYP3A4CASP1CASP7 | |
| SCHEMBL10069619 | 0.84 | KDM5B (0.34) | CYP3A4KDM5BTP53MAPTGNRHR | |
| SCHEMBL10069611 | 0.84 | L3MBTL1 (0.36) | ALDH1A1USP2CYP3A4CYP1A2TSHR | |
| SCHEMBL10069601 | 0.82 | ALDH1A1 (0.36) | ALDH1A1CYP3A4CASP1CASP7CYP1A2 | |
| SCHEMBL10069631 | 0.81 | RGS4 (0.34) | ALDH1A1KDM5BKMT2ASMN1; SMN2KDM4E | |
| SCHEMBL10069627 | 0.80 | ALDH1A1 (0.34) | ALDH1A1HSD17B10MEN1KMT2ASMN1; SMN2 | |
| SCHEMBL10069596 | 0.80 | MAPT (0.36) | ALDH1A1USP2CYP3A4CASP1CASP7 | |
| SCHEMBL10069598 | 0.80 | TP53 (0.33) | TP53MAPT | |
| SCHEMBL10069629 | 0.80 | RGS4 (0.35) | ALDH1A1TSHRLMNASMN1; SMN2KDM4E | |
| SCHEMBL10069597 | 0.80 | ANO1 (0.36) | KDM5BLMNASMN1; SMN2MAPTL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012047993-A2 | N-HYDROXYPYRIMIDINE-2,4-DIONES AS INHIBITORS OF HIV AND HCV | REGENTS OF THE UNIVERSITY OF MINNESOTA (US) | 2012-04-12 | — | — | WO | disclosed |