Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPBAR1 | Q8TDU6 | 5/20 | 0.76 |
| ▸ | EPHA2 | P29317 | 3/20 | 0.76 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.76 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.76 |
| ▸ | AKR1B10 | O60218 | 2/20 | 0.76 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.76 |
| ▸ | LMNA | P02545 | 2/20 | 0.76 |
| ▸ | EFNA1 | P20827 | 1/20 | 0.76 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.76 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.76 |
| ▸ | APH1B | Q8WW43 | 1/20 | 0.76 |
| ▸ | NCSTN | Q92542 | 1/20 | 0.76 |
| ▸ | APH1A | Q96BI3 | 1/20 | 0.76 |
| ▸ | PSENEN | Q9NZ42 | 1/20 | 0.76 |
| ▸ | MEN1 | O00255 | 1/20 | 0.76 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.76 |
| ▸ | VDR | P11473 | 4/20 | 0.62 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.62 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.62 |
| ▸ | USP2 | O75604 | 2/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL10569878 | 1.00 | GPBAR1 (0.76) | GPBAR1EPHA2HSD17B10TDP1AKR1B10 | |
| SCHEMBL23710441 | 0.92 | GPBAR1 (0.73) | GPBAR1EPHA2HSD17B10TDP1AKR1B10 | |
| SCHEMBL19086187 | 0.90 | GPBAR1 (0.73) | GPBAR1EPHA2HSD17B10TDP1AKR1B10 | |
| SCHEMBL28124403 | 0.90 | GPBAR1 (0.73) | GPBAR1EPHA2HSD17B10TDP1AKR1B10 | |
| SCHEMBL6676374 | 0.90 | GPBAR1 (0.78) | GPBAR1EPHA2HSD17B10TDP1AKR1B10 | |
| SCHEMBL21752770 | 0.90 | GPBAR1 (0.78) | GPBAR1EPHA2HSD17B10TDP1AKR1B10 | |
| SCHEMBL8965370 | 0.90 | GPBAR1 (0.78) | GPBAR1EPHA2HSD17B10TDP1AKR1B10 | |
| SCHEMBL18844053 | 0.90 | GPBAR1 (0.78) | GPBAR1EPHA2HSD17B10TDP1AKR1B10 | |
| SCHEMBL24151937 | 0.90 | GPBAR1 (0.78) | GPBAR1EPHA2HSD17B10TDP1AKR1B10 | |
| SCHEMBL16892648 | 0.90 | GPBAR1 (0.78) | GPBAR1EPHA2HSD17B10TDP1AKR1B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-106478757-A | 3 α of one kind, the preparation method of 7 α dihydroxy, 6 α ethyl cholanic acid | 华南理工大学 | 2017-03-08 | — | — | CN | disclosed |
| CN-104558086-B | A kind of 5 β-3 α, the preparation method of 7 alpha-dihydroxy-6 α-ethyl-cholanic acid | 康美（北京）药物研究院有限公司 | 2016-10-05 | — | — | CN | disclosed |