Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 4/20 | 0.30 |
| ▸ | DRD4 | P21917 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1046899 | 1.00 | ALDH1A1 (0.38) | ALDH1A1POLBSMN1; SMN2MAPTNPSR1 | |
| SCHEMBL25246573 | 0.98 | ALDH1A1 (0.38) | ALDH1A1POLBSMN1; SMN2MAPTNPSR1 | |
| Hydrochloric Acid SCHEMBL819402 | 0.98 | ALDH1A1 (0.38) | ALDH1A1POLBSMN1; SMN2MAPTNPSR1 | |
| SCHEMBL28532318 | 0.87 | ALDH1A1 (0.32) | ALDH1A1POLB | |
| SCHEMBL23637519 | 0.74 | ALDH1A1 (0.33) | ALDH1A1POLBSMN1; SMN2MAPTNPSR1 | |
| SCHEMBL283988 | 0.74 | ALDH1A1 (0.52) | ALDH1A1POLBSMN1; SMN2MAPTNPSR1 | |
| Hydrochloric Acid SCHEMBL451487 | 0.72 | ALDH1A1 (0.50) | ALDH1A1POLBSMN1; SMN2MAPTNPSR1 | |
| Hydrochloric Acid SCHEMBL28554078 | 0.72 | ALDH1A1 (0.50) | ALDH1A1POLBSMN1; SMN2MAPTNPSR1 | |
| Bromide SCHEMBL1608735 | 0.72 | ALDH1A1 (0.50) | ALDH1A1POLBSMN1; SMN2MAPTNPSR1 | |
| SCHEMBL455945 | 0.70 | TP53 (0.36) | ALDH1A1POLBSMN1; SMN2TP53GAA |
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-9938253-B2 | Catalysts for efficient Z-selective metathesis | TRUSTEES OF BOSTON COLLEGE (US) | 2018-04-10 | — | — | US | disclosed |