Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 1/20 | 0.47 |
| ▸ | LCK | P06239 | 3/20 | 0.41 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | MIF | P14174 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
| ▸ | RECQL | P46063 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL26429672 | 0.81 | ATR (0.41) | ATRLCKCA12CA1CA9 | |
| SCHEMBL29951650 | 0.81 | ALDH1A1 (0.42) | ATRMIFHDAC3HDAC1HDAC2 | |
| SCHEMBL19944782 | 0.81 | ALDH1A1 (0.42) | ATRMIFHDAC3HDAC1HDAC2 | |
| SCHEMBL29953301 | 0.79 | CA12 (0.43) | ATRCA12CA1CA9HDAC3 | |
| SCHEMBL12527219 | 0.79 | CA12 (0.43) | ATRCA12CA1CA9HDAC3 | |
| SCHEMBL3119352 | 0.79 | CA12 (0.45) | ATRCA12CA1CA9MIF | |
| SCHEMBL29955278 | 0.78 | ATR (0.44) | ATRLCKCA12CA1CA9 | |
| SCHEMBL29956714 | 0.78 | PDK1 (0.44) | ATRMIFHDAC3HDAC1HDAC2 | |
| SCHEMBL17208821 | 0.77 | ATR (0.51) | ATRLCKNPC1RAB9ACYP17A1 | |
| SCHEMBL11611125 | 0.76 | ALDH1A1 (0.41) | CA1CA9CA2KDM4EALDH1A1 |
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-20220340893-A1 | BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES | NUEVOLUTION A/S (DK) | 2022-10-27 | — | — | US | disclosed |