Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.65 |
| ▸ | HSP90AA1 | P07900 | 6/20 | 0.65 |
| ▸ | TDP1 | Q9NUW8 | 5/20 | 0.65 |
| ▸ | LMNA | P02545 | 4/20 | 0.65 |
| ▸ | RAB9A | P51151 | 4/20 | 0.65 |
| ▸ | NPC1 | O15118 | 4/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.65 |
| ▸ | MITF | O75030 | 1/20 | 0.65 |
| ▸ | ALOX12 | P18054 | 5/20 | 0.61 |
| ▸ | KDM1A | O60341 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.61 |
| ▸ | HTT | P42858 | 3/20 | 0.61 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.61 |
| ▸ | ADAMTS5 | Q9UNA0 | 9/20 | 0.60 |
| ▸ | USP2 | O75604 | 1/20 | 0.60 |
| ▸ | TP53 | P04637 | 1/20 | 0.60 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | MEN1 | O00255 | 3/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL30876681 | 0.87 | RAB9A (0.77) | KDM4EHSP90AA1TDP1LMNARAB9A | |
| SCHEMBL24634767 | 0.87 | RAB9A (0.77) | KDM4EHSP90AA1TDP1LMNARAB9A | |
| SCHEMBL30876669 | 0.87 | ADAMTS5 (0.71) | KDM4EHSP90AA1TDP1LMNARAB9A | |
| SCHEMBL24634728 | 0.87 | ADAMTS5 (0.71) | KDM4EHSP90AA1TDP1LMNARAB9A | |
| SCHEMBL24634692 | 0.86 | KDM4E (0.58) | KDM4EHSP90AA1TDP1LMNARAB9A | |
| SCHEMBL29856203 | 0.86 | KDM4E (0.58) | KDM4EHSP90AA1TDP1LMNARAB9A | |
| SCHEMBL30876655 | 0.86 | KDM4E (0.70) | KDM4EHSP90AA1TDP1LMNARAB9A | |
| SCHEMBL24634729 | 0.86 | KDM4E (0.70) | KDM4EHSP90AA1TDP1LMNARAB9A | |
| SCHEMBL27768738 | 0.85 | HSP90AA1 (0.71) | KDM4EHSP90AA1TDP1LMNARAB9A | |
| SCHEMBL24634768 | 0.84 | KDM4E (0.74) | KDM4EHSP90AA1TDP1LMNARAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4288416-A2 | SMALL MOLECULE INHIBITORS OF GRP78 AND USES THEREOF | The Regents Of The University Of Michigan (US) | 2023-12-13 | — | — | EP | disclosed |
| WO-2022169834-A2 | SMALL MOLECULE INHIBITORS OF GRP78 AND USES THEREOF | THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) | 2022-08-11 | — | — | WO | disclosed |
| WO-2022169834-A2 | SMALL MOLECULE INHIBITORS OF GRP78 AND USES THEREOF | THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) | 2022-08-11 | — | — | WO | disclosed |