Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CTSK | P43235 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | CNR2 | P34972 | 2/20 | 0.39 |
| ▸ | AR | P10275 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 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 | |
|---|---|---|---|---|
| SCHEMBL10737848 | 0.73 | MAPT (0.45) | ALDH1A1LMNAMAPTHTTTDP1 | |
| SCHEMBL10692036 | 0.69 | MKNK1 (0.40) | ALDH1A1MAPTHTTRAB9A | |
| SCHEMBL15797544 | 0.68 | CYP3A4 (0.39) | ALDH1A1CTSKHTTKDM4ESMN1; SMN2 | |
| SCHEMBL11640160 | 0.67 | ALDH1A1 (0.42) | ALDH1A1CTSKLMNAHTTKDM4E | |
| SCHEMBL5282593 | 0.67 | GAA (0.46) | ALDH1A1LMNAMAPTHTTRAB9A | |
| SCHEMBL9203937 | 0.66 | ACHE (0.34) | ALDH1A1HTTKDM4ESMN1; SMN2KMT2A | |
| SCHEMBL11460905 | 0.65 | GAA (0.46) | ALDH1A1LMNAKDM4ESMN1; SMN2CYP3A4 | |
| SCHEMBL625631 | 0.65 | PNMT (0.47) | KCNH2LMNAMAPTDRD3HTR2B | |
| Hydrochloric Acid SCHEMBL10740874 | 0.65 | HTR2C (0.44) | CTSKKCNH2MAPTKDM4EKMT2A | |
| SCHEMBL11158619 | 0.64 | RPS6KB1 (0.54) | ALDH1A1LMNAHTTCNR2KDM4E |
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-4112095-A | 6-Phenyl-1,2,4-triazolo[4,3-b]pyridazine hypotensive agents | AMERICAN CYANAMID COMPANY (US) | 1978-09-05 | — | — | US | disclosed |