Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.59 |
| ▸ | GAA | P10253 | 1/20 | 0.59 |
| ▸ | DPP4 | P27487 | 7/20 | 0.57 |
| ▸ | DPP7 | Q9UHL4 | 7/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 4/20 | 0.57 |
| ▸ | CTSL | P07711 | 1/20 | 0.55 |
| ▸ | CTSB | P07858 | 1/20 | 0.55 |
| ▸ | CTSK | P43235 | 1/20 | 0.55 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.51 |
| ▸ | KDM1A | O60341 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 1/20 | 0.48 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28356285 | 1.00 | TSHR (0.60) | TSHRALDH1A1GAADPP4DPP7 | |
| Hydrochloric Acid SCHEMBL28353182 | 0.99 | TSHR (0.59) | TSHRALDH1A1GAADPP4DPP7 | |
| Hydrochloric Acid SCHEMBL28353179 | 0.99 | TSHR (0.59) | TSHRALDH1A1GAADPP4DPP7 | |
| SCHEMBL19562716 | 0.87 | ALDH1A1 (0.60) | TSHRALDH1A1GAADPP4DPP7 | |
| SCHEMBL19021217 | 0.85 | ALDH1A1 (0.63) | TSHRALDH1A1GAADPP4DPP7 | |
| SCHEMBL16604750 | 0.85 | ALDH1A1 (0.63) | TSHRALDH1A1GAADPP4DPP7 | |
| SCHEMBL19021218 | 0.85 | ALDH1A1 (0.63) | TSHRALDH1A1GAADPP4DPP7 | |
| SCHEMBL16604745 | 0.85 | ALDH1A1 (0.63) | TSHRALDH1A1GAADPP4DPP7 | |
| SCHEMBL19021215 | 0.85 | ALDH1A1 (0.63) | TSHRALDH1A1GAADPP4DPP7 | |
| SCHEMBL8785297 | 0.84 | ALDH1A1 (0.57) | TSHRALDH1A1GAADPP4DPP7 |
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-110770224-B | Indole derivatives as efflux pump inhibitors | 罗格斯新泽西州立大学 | 2022-11-18 | — | — | CN | disclosed |
| CN-110770224-A | Indole derivatives as efflux pump inhibitors | 罗格斯新泽西州立大学 | 2020-02-07 | — | — | CN | disclosed |