Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.56 |
| ▸ | ESR1 | P03372 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | MITF | O75030 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | TBXAS1 | P24557 | 4/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.46 |
| ▸ | BAZ2B | Q9UIF8 | 1/20 | 0.46 |
| ▸ | MLLT1 | Q03111 | 1/20 | 0.44 |
| ▸ | ADH5 | P11766 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7290212 | 1.00 | MAOB (0.56) | MAOBESR1MEN1KMT2AKDM4E | |
| SCHEMBL16789347 | 0.85 | MAOB (0.63) | MAOBESR1MEN1KMT2AKDM4E | |
| SCHEMBL1238616 | 0.79 | ESR1 (0.67) | MAOBESR1MEN1KMT2AKDM4E | |
| SCHEMBL1238620 | 0.79 | ESR1 (0.67) | MAOBESR1MEN1KMT2AKDM4E | |
| SCHEMBL10625333 | 0.79 | CYP3A4 (0.58) | MAOBKMT2AMAPTTBXAS1CYP3A4 | |
| SCHEMBL19262266 | 0.79 | MAOB (0.56) | MAOBESR1MEN1KMT2AKDM4E | |
| Hydrochloric Acid SCHEMBL7328751 | 0.78 | ESR1 (0.65) | MAOBESR1MEN1KMT2AKDM4E | |
| Hydrochloric Acid SCHEMBL7328757 | 0.78 | ESR1 (0.65) | MAOBESR1MEN1KMT2AKDM4E | |
| SCHEMBL7296206 | 0.78 | MAOB (0.57) | MAOBESR1MEN1KMT2AKDM4E | |
| SCHEMBL7296217 | 0.78 | MAOB (0.57) | MAOBESR1MEN1KMT2AKDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4599332-A | CARDIOTONIC, HYPOTENSIVE | WARNER-LAMBERT COMPANY (US) | 1986-07-08 | — | — | US | disclosed |
| EP-0145450-A2 | 6- [2-[4-(1H-imidazol-1-yl)phenyl]-alkylene and alkylenyl]-3(2H)-pyridazinones, the 4,5-dihydro- pyridazinone derivatives thereof, and a process for the preparation thereof | WARNER-LAMBERT COMPANY (US) | 1985-06-19 | — | — | EP | disclosed |