Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | GPR65 | Q8IYL9 | 2/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.34 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.34 |
| ▸ | P2RX7 | Q99572 | 2/20 | 0.34 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.33 |
| ▸ | CDK2 | P24941 | 1/20 | 0.33 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | F2 | P00734 | 1/20 | 0.33 |
| ▸ | MGLL | Q99685 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL11363313 | 0.73 | ALDH1A1 (0.44) | PTGS1EPHX2ALDH1A1 | |
| SCHEMBL11085199 | 0.68 | PTGS1 (0.72) | KMT2APTGS1RAB9AP2RX7ALDH1A1 | |
| SCHEMBL19014041 | 0.62 | KMT2A (0.50) | KMT2AGAARAB9ATDP1P2RX7 | |
| SCHEMBL19014514 | 0.59 | P2RX7 (0.49) | GAARAB9ATDP1P2RX7MGLL | |
| SCHEMBL20682253 | 0.59 | KDM4E (0.46) | KMT2AGAARAB9ATDP1P2RX7 | |
| SCHEMBL11117707 | 0.58 | PTGS1 (0.70) | KMT2APTGS1GAARAB9AP2RX7 | |
| SCHEMBL11360399 | 0.58 | JAK3 (0.32) | GPR65MGLL | |
| SCHEMBL11351452 | 0.58 | KMT2A (0.33) | KMT2AGPR65MGLL | |
| SCHEMBL10243903 | 0.57 | HSD11B1 (0.51) | KMT2AGAARAB9AP2RX7MGLL | |
| SCHEMBL17350802 | 0.57 | HSD11B1 (0.51) | KMT2AGAARAB9AP2RX7MGLL |
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-4277472-A | 3,6-Disubstituted-5,7-(lower alkano)-5,6,7,8-tetrahydropyrido(4,3-C)pyridazines; their intermediates, preparation, antihypertensive use and compositions | BYK GULDEN LOMBERG CHEMISCHE FABRIK GMBH (DE) | 1981-07-07 | — | — | US | disclosed |