Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR7 | P34969 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 3/20 | 0.45 |
| ▸ | HSD17B3 | P37058 | 2/20 | 0.43 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.41 |
| ▸ | RECQL | P46063 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.40 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.40 |
| ▸ | PLA2G5 | P39877 | 1/20 | 0.40 |
| ▸ | RARB | P10826 | 2/20 | 0.39 |
| ▸ | RARA | P10276 | 1/20 | 0.39 |
| ▸ | RARG | P13631 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL31344360 | 0.88 | HPGD (0.52) | HTR7HTTHSD17B3RECQLALDH1A1 | |
| SCHEMBL2298671 | 0.88 | HPGD (0.52) | HTR7HTTHSD17B3RECQLALDH1A1 | |
| SCHEMBL6626651 | 0.82 | SLC22A6 (0.44) | GABRA1GABRB2ALDH1A1TSHRTDP1 | |
| Formic Acid SCHEMBL5566788 | 0.81 | HPGD (0.46) | HSD17B3GABRA1GABRB2RECQLALDH1A1 | |
| SCHEMBL28062364 | 0.80 | HTR7 (0.59) | HTR7HTTHSD17B3ALDH1A1HPGD | |
| SCHEMBL15490065 | 0.79 | ALDH1A1 (0.44) | HTTALDH1A1HPGDALOX15TSHR | |
| Valeric Acid SCHEMBL29009738 | 0.78 | AKR1B1 (0.56) | HTR7RECQLALDH1A1HPGDALOX15 | |
| SCHEMBL23728983 | 0.78 | POLB (0.50) | HTR7HTTHSD17B3ALDH1A1HPGD | |
| Cadaverine Tartrate SCHEMBL17926713 | 0.78 | HPGD (0.42) | HSD17B3GABRA1GABRB2RECQLALDH1A1 | |
| SCHEMBL6757360 | 0.76 | HDAC3 (0.55) | HTR7HSD17B3GABRA1GABRB2RECQL |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105531277-B | Pyrrolo-imidazole ring derivatives and their use in medicine | 四川海思科制药有限公司 | 2018-03-02 | — | — | CN | disclosed |
| CN-105531277-A | Pyrrolo-imidazole ring derivatives and their use in medicine | SICHUAN HAISCO PHARMACEUTICAL CO LTD | 2016-04-27 | — | — | CN | disclosed |
| CN-105518008-A | Amino pyranoid ring derivative and composition and use thereof | SICHUAN HAISCO PHARMACEUTICAL CO LTD | 2016-04-20 | — | — | CN | disclosed |