Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.64 |
| ▸ | HTR1D | P28221 | 2/20 | 0.64 |
| ▸ | HTR6 | P50406 | 2/20 | 0.64 |
| ▸ | HTR7 | P34969 | 2/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.64 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.64 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.64 |
| ▸ | HTR3A | P46098 | 1/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.64 |
| ▸ | RAD52 | P43351 | 1/20 | 0.64 |
| ▸ | BLM | P54132 | 1/20 | 0.64 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.64 |
| ▸ | SPR | P35270 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 4/20 | 0.53 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.44 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28662910 | 0.86 | ALDH1A1 (0.48) | HSD17B10HTR1DHTR6HTR7CYP1A2 | |
| SCHEMBL28649794 | 0.86 | HTR6 (0.56) | HSD17B10HTR1DHTR6HTR7CYP1A2 | |
| SCHEMBL28679883 | 0.82 | ALDH1A1 (0.59) | HTR1DHTR6HTR7CYP3A4TDP1 | |
| SCHEMBL27380744 | 0.79 | HTR7 (0.64) | HSD17B10HTR1DHTR6HTR7CYP1A2 | |
| SCHEMBL29361176 | 0.79 | HTR6 (1.00) | HSD17B10HTR1DHTR6HTR7CYP1A2 | |
| SCHEMBL399028 | 0.79 | HTR6 (1.00) | HSD17B10HTR1DHTR6HTR7CYP1A2 | |
| Fumaric Acid SCHEMBL1320838 | 0.78 | NPSR1 (1.00) | HSD17B10HTR1DHTR6HTR7CYP1A2 | |
| Maleic Acid SCHEMBL1320833 | 0.78 | NPSR1 (1.00) | HSD17B10HTR1DHTR6HTR7CYP1A2 | |
| SCHEMBL852745 | 0.78 | HSD17B10 (0.67) | HSD17B10HTR1DHTR6HTR7CYP1A2 | |
| Hydrochloric Acid SCHEMBL5791576 | 0.77 | HTR6 (0.97) | HSD17B10HTR1DHTR6HTR7CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-105916840-A | Indole compound | 安斯泰来制药株式会社 | 2016-08-31 | — | — | CN | disclosed |