Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | P2RX7 | Q99572 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | ATR | Q13535 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | GMNN | O75496 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.32 |
| ▸ | MMP2 | P08253 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | MMP8 | P22894 | 1/20 | 0.32 |
| ▸ | CCR1 | P32246 | 1/20 | 0.32 |
| ▸ | THPO | P40225 | 1/20 | 0.32 |
| ▸ | MTOR | P42345 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8677005 | 0.92 | P2RX7 (0.33) | P2RX7 | |
| SCHEMBL5951409 | 0.84 | ADRA1A (0.31) | — | |
| SCHEMBL8674351 | 0.84 | P2RX7 (0.36) | P2RX7ALDH1A1LMNAKDM4EGMNN | |
| SCHEMBL5951251 | 0.84 | KDM4E (0.34) | ALDH1A1KDM4ETP53MAPTTSHR | |
| SCHEMBL2508944 | 0.84 | — | — | |
| SCHEMBL5889890 | 0.83 | KDM4E (0.33) | ALDH1A1KDM4ETP53MAPTTSHR | |
| SCHEMBL8677011 | 0.83 | CCR1 (0.34) | P2RX7ALDH1A1LMNAKDM4EGMNN | |
| Hydrochloric Acid SCHEMBL8673756 | 0.82 | ALDH1A1 (0.34) | P2RX7ALDH1A1ATRLMNAKDM4E | |
| SCHEMBL8675789 | 0.82 | P2RX7 (0.34) | P2RX7ALDH1A1LMNAKDM4EGMNN | |
| SCHEMBL8673507 | 0.82 | BRD4 (0.36) | P2RX7ATRMMP9BRD4METAP2 |
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-5840947-A | Organometallic compound | TARGOR GMBH (DE) | 1998-11-24 | — | — | US | claimed |
| US-5840947-A | Organometallic compound | TARGOR GMBH (DE) | 1998-11-24 | — | — | US | disclosed |