Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.42 |
| ▸ | CES2 | O00748 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | GMNN | O75496 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.36 |
| ▸ | PRKCG | P05129 | 1/20 | 0.36 |
| ▸ | PRKCB | P05771 | 1/20 | 0.36 |
| ▸ | PRKCA | P17252 | 1/20 | 0.36 |
| ▸ | PRKCH | P24723 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9426392 | 0.98 | CES2 (0.42) | ALDH1A1TSHRCES2HSD17B10GMNN | |
| SCHEMBL8023801 | 0.98 | CES2 (0.42) | ALDH1A1TSHRCES2HSD17B10GMNN | |
| SCHEMBL11464256 | 0.94 | ALDH1A1 (0.39) | ALDH1A1TSHRCES2HSD17B10GMNN | |
| SCHEMBL8019833 | 0.90 | ALDH1A1 (0.46) | ALDH1A1TSHRCES2HSD17B10GMNN | |
| SCHEMBL8009891 | 0.90 | ALDH1A1 (0.46) | ALDH1A1TSHRCES2HSD17B10GMNN | |
| SCHEMBL948108 | 0.87 | TSHR (0.50) | ALDH1A1TSHRCES2HSD17B10GMNN | |
| SCHEMBL19627041 | 0.87 | TSHR (0.50) | ALDH1A1TSHRCES2HSD17B10GMNN | |
| SCHEMBL11544048 | 0.87 | TDP1 (0.36) | ALDH1A1TSHRHSD17B10TP53 | |
| SCHEMBL7483245 | 0.87 | TSHR (0.50) | ALDH1A1TSHRCES2HSD17B10GMNN | |
| SCHEMBL31357726 | 0.87 | TSHR (0.50) | ALDH1A1TSHRCES2HSD17B10GMNN |
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-4223138-A | VAPORIZATION, CONDENSATION, RETARDING FLOW TO REACTION ZONE | BAYER AKTIENGESELLSCHAFT (DE) | 1980-09-16 | — | — | US | disclosed |