Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | TP53 | P04637 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MTOR | P42345 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | THPO | P40225 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | BLM | P54132 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9463266 | 0.86 | KDM4E (0.43) | KDM4ECYP2D6TP53ALOX15MAPT | |
| Acetic Acid SCHEMBL8827757 | 0.80 | KDM4E (0.53) | KDM4ECYP2D6TP53ALOX15MAPT | |
| SCHEMBL2598853 | 0.79 | ACHE (0.50) | KDM4ECYP2D6MAPTCYP1A2HIF1A | |
| SCHEMBL2456789 | 0.79 | KDM4E (0.59) | KDM4ECYP2D6TP53ALOX15MAPT | |
| SCHEMBL2456790 | 0.79 | KDM4E (0.59) | KDM4ECYP2D6TP53ALOX15MAPT | |
| SCHEMBL9536827 | 0.79 | KDM4E (0.59) | KDM4ECYP2D6TP53ALOX15MAPT | |
| SCHEMBL9463762 | 0.79 | KDM4E (0.63) | KDM4ECYP2D6TP53ALOX15MAPT | |
| Hydrochloric Acid SCHEMBL8827744 | 0.78 | ACHE (0.49) | KDM4ECYP2D6MAPTCYP1A2HIF1A | |
| Hydrochloric Acid SCHEMBL8827752 | 0.78 | ACHE (0.49) | KDM4ECYP2D6MAPTCYP1A2HIF1A | |
| SCHEMBL9207689 | 0.78 | ACHE (0.51) | KDM4ECYP2D6MAPTCYP1A2HIF1A |
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-5216017-A | Antishock agent, cholinergic agent; learning enhancement, alzheimer's disease | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1993-06-01 | — | — | US | disclosed |
| EP-0456196-A1 | Pyrrolo,[2,3-b]indole-ketones and analogs, a process for their preparation and their use as medicaments | HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) | 1991-11-13 | — | — | EP | disclosed |