Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | NSD1 | Q96L73 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | TNF | P01375 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.38 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.38 |
| ▸ | NSD2 | O96028 | 1/20 | 0.37 |
| ▸ | NSD3 | Q9BZ95 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | PKM | P14618 | 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 | |
|---|---|---|---|---|
| SCHEMBL23196210 | 0.86 | ALDH1A1 (0.51) | ALDH1A1LMNASMN1; SMN2HSD17B10NSD1 | |
| SCHEMBL2275450 | 0.84 | LMNA (0.51) | ALDH1A1LMNASMN1; SMN2HSD17B10CYP2C19 | |
| SCHEMBL19899989 | 0.80 | ALDH1A1 (0.47) | ALDH1A1LMNASMN1; SMN2HSD17B10MEN1 | |
| SCHEMBL14044812 | 0.75 | HSD17B10 (0.68) | ALDH1A1LMNASMN1; SMN2HSD17B10NSD1 | |
| SCHEMBL474219 | 0.74 | ALDH1A1 (0.61) | ALDH1A1LMNASMN1; SMN2HSD17B10NSD1 | |
| SCHEMBL21289918 | 0.74 | CYP2C19 (0.38) | ALDH1A1LMNASMN1; SMN2HSD17B10NSD1 | |
| SCHEMBL17859475 | 0.72 | RAB9A (0.40) | ALDH1A1LMNASMN1; SMN2HSD17B10MEN1 | |
| SCHEMBL2314657 | 0.71 | NSD1 (0.64) | ALDH1A1LMNASMN1; SMN2HSD17B10NSD1 | |
| SCHEMBL13486488 | 0.71 | ALDH1A1 (0.57) | ALDH1A1LMNASMN1; SMN2HSD17B10NSD1 | |
| SCHEMBL19939699 | 0.71 | ALDH1A1 (0.53) | ALDH1A1LMNASMN1; SMN2HSD17B10NSD1 |
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-2019007418-A1 | FXR RECEPTOR AGONIST | 山东轩竹医药科技有限公司 | 2019-01-10 | — | — | WO | disclosed |