Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | ACACB | O00763 | 1/20 | 0.43 |
| ▸ | STAT3 | P40763 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | EBP | Q15125 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| Oxalic Acid SCHEMBL10988556 | 0.96 | KDM4E (0.46) | CYP1A2CYP2D6HRH3CYP3A4LTA4H | |
| Oxalic Acid SCHEMBL10988553 | 0.96 | KDM4E (0.46) | CYP1A2CYP2D6HRH3CYP3A4LTA4H | |
| SCHEMBL11007885 | 0.88 | KDM4E (0.52) | HRH3LTA4HALDH1A1RAB9AKDM4E | |
| SCHEMBL11009563 | 0.86 | LMNA (0.47) | CYP1A2CYP2D6HRH3CYP3A4ACACB | |
| SCHEMBL10989601 | 0.86 | HRH3 (0.47) | CYP1A2CYP2D6HRH3CYP3A4ACACB | |
| SCHEMBL10992561 | 0.86 | MMP2 (0.48) | CYP1A2CYP2D6HRH3CYP3A4ACACB | |
| Oxalic Acid SCHEMBL10995840 | 0.85 | KDM4E (0.58) | HRH3LTA4HPOLBALDH1A1RAB9A | |
| SCHEMBL10920330 | 0.81 | MAPT (0.43) | CYP1A2CYP2D6HRH3CYP3A4ALDH1A1 | |
| Fumaric Acid SCHEMBL10993756 | 0.81 | LMNA (0.43) | CYP1A2CYP2D6HRH3CYP3A4ACACB | |
| Maleic Acid SCHEMBL10922870 | 0.81 | LMNA (0.43) | CYP1A2CYP2D6HRH3CYP3A4ACACB |
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-4500529-A | ANTIARRHYTHMIA AGENT | A. H. ROBINS COMPANY, INCORPORATED (US) | 1985-02-19 | — | — | US | claimed |