Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.38 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.38 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.38 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | GRN | P28799 | 2/20 | 0.36 |
| ▸ | SORT1 | Q99523 | 2/20 | 0.36 |
| ▸ | TPMT | P51580 | 1/20 | 0.36 |
| ▸ | FLT1 | P17948 | 1/20 | 0.36 |
| ▸ | FLT4 | P35916 | 1/20 | 0.36 |
| ▸ | KDR | P35968 | 1/20 | 0.36 |
| ▸ | FABP4 | P15090 | 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 | |
|---|---|---|---|---|
| SCHEMBL5152205 | 1.00 | ALDH1A1 (0.41) | ALDH1A1HPGDPDE3BKDM4EPOLB | |
| SCHEMBL15269861 | 0.87 | HDAC8 (0.47) | ALDH1A1HPGDPDE3BHDAC8HDAC6 | |
| SCHEMBL3786661 | 0.82 | HDAC8 (0.50) | ALDH1A1HPGDKDM4EPOLBSCN9A | |
| SCHEMBL1003995 | 0.82 | TPMT (0.52) | ALDH1A1HPGDKDM4EPOLBSCN9A | |
| SCHEMBL29956823 | 0.81 | RAB9A (0.45) | HPGDRAB9AGRNSORT1FABP4 | |
| SCHEMBL14060074 | 0.79 | TPMT (0.48) | ALDH1A1HPGDKDM4EPOLBSCN9A | |
| SCHEMBL585279 | 0.79 | ALDH1A1 (0.47) | ALDH1A1HPGDPDE3BKDM4EPOLB | |
| SCHEMBL2013972 | 0.79 | MAP4K4 (0.39) | ALDH1A1HPGDPDE3BKDM4ERAB9A | |
| SCHEMBL29951837 | 0.77 | TPMT (0.64) | TPMTTSHR | |
| SCHEMBL1853365 | 0.77 | TPMT (0.64) | TPMTTSHR |
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 |