Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 9/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | CFTR | P13569 | 1/20 | 0.39 |
| ▸ | F2RL3 | Q96RI0 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.36 |
| ▸ | PSD | A5PKW4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL10069632 | 0.88 | ALDH1A1 (0.43) | HTTNPC1RAB9AALDH1A1POLB | |
| SCHEMBL10069623 | 0.86 | ALDH1A1 (0.42) | ARKMT2AMEN1KDM4ENPC1 | |
| SCHEMBL10069592 | 0.86 | MEN1 (0.40) | ARKMT2AMEN1KDM4EHTT | |
| SCHEMBL10069621 | 0.85 | ALDH1A1 (0.39) | ARKMT2AKDM4EHTTNPC1 | |
| SCHEMBL1287915 | 0.85 | ALDH1A1 (0.39) | ARKMT2AMEN1ALDH1A1POLB | |
| SCHEMBL10069625 | 0.81 | ALDH1A1 (0.41) | NPC1RAB9AALDH1A1POLB | |
| SCHEMBL1687638 | 0.80 | ADORA2A (0.36) | ARKDM4EALDH1A1ADORA2AADORA2B | |
| SCHEMBL10069613 | 0.80 | ALDH1A1 (0.40) | ARKMT2AMEN1KDM4EHTT | |
| SCHEMBL10069615 | 0.76 | ERCC5 (0.39) | KMT2AMEN1KDM4EHTTRAB9A | |
| SCHEMBL10069612 | 0.76 | ALDH1A1 (0.37) | KMT2AMEN1KDM4EALDH1A1POLB |
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 |