Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | G6PD | P11413 | 1/20 | 0.48 |
| ▸ | GMNN | O75496 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | THRB | P10828 | 1/20 | 0.48 |
| ▸ | BLM | P54132 | 1/20 | 0.48 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.47 |
| ▸ | MTOR | P42345 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | THPO | P40225 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL2598855 | 0.86 | KDM4E (0.54) | KDM4EMAPTALDH1A1SMN1; SMN2G6PD | |
| Acetic Acid SCHEMBL8827757 | 0.85 | KDM4E (0.53) | KDM4EMAPTALDH1A1SMN1; SMN2G6PD | |
| SCHEMBL2456789 | 0.85 | KDM4E (0.59) | KDM4EMAPTALDH1A1SMN1; SMN2G6PD | |
| SCHEMBL9536827 | 0.85 | KDM4E (0.59) | KDM4EMAPTALDH1A1SMN1; SMN2G6PD | |
| Diphenylacetic Acid SCHEMBL8827826 | 0.84 | KDM4E (0.48) | KDM4EMAPTALDH1A1SMN1; SMN2G6PD | |
| Pivalate SCHEMBL8827801 | 0.82 | KDM4E (0.50) | KDM4EMAPTALDH1A1SMN1; SMN2G6PD | |
| Heptanoate SCHEMBL2455057 | 0.81 | KDM4E (0.45) | KDM4EMAPTALDH1A1SMN1; SMN2G6PD | |
| SCHEMBL9463261 | 0.78 | KDM4E (0.43) | KDM4EMAPTALDH1A1SMN1; SMN2G6PD | |
| Salicylic Acid SCHEMBL9538265 | 0.77 | BCHE (0.48) | ACHEBCHE | |
| Salicylic Acid SCHEMBL9537204 | 0.76 | BCHE (0.45) | KDM4EMAPTALDH1A1SMN1; SMN2G6PD |
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-5187165-A | Eseroline derivatives; cholinergic agents; antidepressants | HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) | 1993-02-16 | — | — | US | disclosed |