Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.32 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | LDHA | P00338 | 1/20 | 0.30 |
| ▸ | SRR | Q9GZT4 | 1/20 | 0.30 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.30 |
| ▸ | SUCNR1 | Q9BXA5 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28993738 | 0.74 | ALDH1A1 (0.38) | ALDH1A1TSHR | |
| SCHEMBL28435327 | 0.72 | TDP1 (0.45) | ALDH1A1TSHR | |
| SCHEMBL3088243 | 0.72 | — | — | |
| SCHEMBL9700762 | 0.69 | MCL1 (0.34) | LMNA | |
| Bicarbonate SCHEMBL9628164 | 0.69 | ALDH1A1 (0.38) | LMNAALDH1A1TSHR | |
| SCHEMBL175498 | 0.67 | ABCC4 (0.34) | LMNAALOX15ABCC4MAPTHSD17B10 | |
| SCHEMBL10879297 | 0.60 | — | — | |
| Succinic Acid SCHEMBL4061508 | 0.58 | LMNA (0.64) | LMNAABCC4MAPTHSD17B10CYP2D6 | |
| Malonic Acid SCHEMBL17985762 | 0.58 | LDHA (0.64) | LMNAALOX15ABCC4MAPTHSD17B10 | |
| SCHEMBL3420650 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2001094429-A1 | OLIGOMERS AND POLYMERS FROM CROTONIC BETAINE OR CROTONIC BETAINE DERIVATIVES | WELLA AKTIENGESELLSCHAFT (DE) | 2001-12-13 | — | — | WO | disclosed |