Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR6 | P50406 | 1/20 | 0.60 |
| ▸ | IDO1 | P14902 | 2/20 | 0.48 |
| ▸ | TDO2 | P48775 | 1/20 | 0.48 |
| ▸ | MGAM | O43451 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.43 |
| ▸ | SI | P14410 | 2/20 | 0.43 |
| ▸ | MGAM2 | Q2M2H8 | 2/20 | 0.43 |
| ▸ | HTR2A | P28223 | 3/20 | 0.40 |
| ▸ | HTR2C | P28335 | 3/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.40 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.40 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.39 |
| ▸ | PTGES | O14684 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.39 |
| ▸ | TUBB | P07437 | 1/20 | 0.39 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28906358 | 0.81 | ESR1 (0.57) | HTR2AHTR2CDRD2PTGS2ESR1 | |
| SCHEMBL18154511 | 0.78 | ESR1 (0.68) | HTR6IDO1TDO2MGAMGAA | |
| SCHEMBL28906409 | 0.76 | HTR6 (0.65) | HTR6IDO1TDO2MGAMGAA | |
| SCHEMBL30047360 | 0.76 | HTR6 (0.65) | HTR6IDO1TDO2MGAMGAA | |
| SCHEMBL28450069 | 0.73 | TUBB4A (0.51) | HTR6IDO1TDO2MGAMGAA | |
| SCHEMBL18921861 | 0.72 | IDO1 (0.55) | HTR6IDO1TDO2MGAMGAA | |
| SCHEMBL16305032 | 0.72 | IDO1 (0.55) | HTR6IDO1TDO2CAMK2DPTPN1 | |
| SCHEMBL28254268 | 0.72 | HTR6 (0.47) | HTR6IDO1TDO2MGAMGAA | |
| Carbazole SCHEMBL28177170 | 0.72 | ALDH1A1 (0.64) | IDO1TDO2GAACA1CA2 | |
| SCHEMBL1193029 | 0.70 | TDO2 (0.63) | HTR6IDO1TDO2CAMK2D |
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-115304533-A | Bis-indole methane type alpha-glucosidase inhibitor and preparation method and application thereof | 中国医学科学院药用植物研究所云南分所 | 2022-11-08 | — | — | CN | disclosed |