Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | GRM5 | P41594 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.34 |
| ▸ | CASP1 | P29466 | 2/20 | 0.34 |
| ▸ | CASP7 | P55210 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HMGCR | P04035 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | ASAH1 | Q13510 | 1/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | GNRHR | P30968 | 1/20 | 0.33 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL10069611 | 0.96 | L3MBTL1 (0.36) | ALDH1A1L3MBTL1GRM5CYP1A2HMGCR | |
| SCHEMBL10069619 | 0.95 | KDM5B (0.34) | L3MBTL1CYP3A4GNRHR | |
| SCHEMBL10069590 | 0.92 | ALDH1A1 (0.39) | ALDH1A1ELANEERCC5FEN1MAPK1 | |
| SCHEMBL10069602 | 0.90 | ALDH1A1 (0.39) | ALDH1A1L3MBTL1MEN1KMT2AKDM4E | |
| SCHEMBL10069596 | 0.90 | MAPT (0.36) | ALDH1A1CYP1A2CASP1CASP7HSD17B10 | |
| SCHEMBL10069594 | 0.89 | MAPT (0.38) | ALDH1A1GRM5CYP1A2HSD17B10KDM4E | |
| SCHEMBL10069592 | 0.87 | MEN1 (0.40) | ALDH1A1MEN1KMT2AKDM4EELANE | |
| SCHEMBL10069591 | 0.86 | ESR1 (0.35) | ALDH1A1CYP1A2MEN1KMT2AERCC5 | |
| SCHEMBL10069598 | 0.85 | TP53 (0.33) | GRM5HMGCR | |
| SCHEMBL10069595 | 0.85 | ALDH1A1 (0.38) | ALDH1A1GRM5ERCC5FEN1MAPK1 |
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 |