Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 15/20 | 0.87 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.57 |
| ▸ | BCHE | P06276 | 1/20 | 0.57 |
| ▸ | ACHE | P22303 | 1/20 | 0.57 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | RAB9A | P51151 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL27904865 | 0.93 | SIGMAR1 (1.00) | SIGMAR1ABCB1ABCG2KDM4ENPC1 | |
| SCHEMBL31238513 | 0.86 | SIGMAR1 (0.65) | SIGMAR1ABCB1ABCG2KDM4ENPC1 | |
| SCHEMBL8786635 | 0.86 | SIGMAR1 (1.00) | SIGMAR1 | |
| SCHEMBL8787028 | 0.86 | SIGMAR1 (1.00) | SIGMAR1 | |
| SCHEMBL8786990 | 0.86 | SIGMAR1 (1.00) | SIGMAR1 | |
| SCHEMBL8786706 | 0.86 | SIGMAR1 (1.00) | SIGMAR1 | |
| SCHEMBL8788283 | 0.86 | SIGMAR1 (1.00) | SIGMAR1 | |
| SCHEMBL8787025 | 0.86 | SIGMAR1 (1.00) | SIGMAR1 | |
| Hydrochloric Acid SCHEMBL8787136 | 0.86 | SIGMAR1 (0.98) | SIGMAR1ABCB1ABCG2 | |
| SCHEMBL31238455 | 0.85 | SIGMAR1 (0.73) | SIGMAR1ABCB1BCHEABCG2KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024189504-A1 | BROAD - SPECTRUM ANTI VIRAL COMPOUNDS | FOUNDATION FOR NEGLECTED DISEASE RESEARCH (IN) | 2024-09-19 | — | — | WO | claimed |
| WO-2024189504-A1 | BROAD - SPECTRUM ANTI VIRAL COMPOUNDS | FOUNDATION FOR NEGLECTED DISEASE RESEARCH (IN) | 2024-09-19 | — | — | WO | disclosed |