Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDH1 | O75874 | 9/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.35 |
| ▸ | HTR3A | P46098 | 2/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.35 |
| ▸ | HTR3B | O95264 | 1/20 | 0.35 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.35 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.34 |
| ▸ | RORC | P51449 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8540944 | 0.93 | HTR3A (0.43) | IDH1KDM4EALDH1A1GAAADRA1A | |
| SCHEMBL8479741 | 0.92 | ADRA1A (0.40) | IDH1KDM4EADRA1AHTR3AADRA2A | |
| SCHEMBL8538941 | 0.91 | IDH1 (0.38) | IDH1KDM4EADRA1AHTR3AADRA2A | |
| Hydrochloric Acid SCHEMBL8538095 | 0.91 | ADRA1A (0.40) | IDH1KDM4EADRA1AHTR3AADRA2A | |
| Hydrochloric Acid SCHEMBL8539594 | 0.91 | IDH1 (0.37) | IDH1KDM4EADRA1AHTR3AADRA2A | |
| SCHEMBL8542703 | 0.90 | IDH1 (0.35) | IDH1KDM4EADRA1AHTR3AADRA2A | |
| SCHEMBL8543700 | 0.89 | ADRA1A (0.36) | IDH1KDM4EALDH1A1GAAADRA1A | |
| SCHEMBL8544444 | 0.85 | KDM4E (0.40) | IDH1KDM4EADRA1AHTR3AADRA2A | |
| SCHEMBL8525220 | 0.85 | IDH1 (0.36) | IDH1ADRA1AHTR3AADRA2AADRA2B | |
| Hydrochloric Acid SCHEMBL8538933 | 0.85 | KDM4E (0.39) | IDH1KDM4EADRA1AHTR3AADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-0721949-B1 | INDOLINE COMPOUND AND 5-HT 3? RECEPTOR ANTAGONIST CONTAINING THE SAME AS ACTIVE INGREDIENT | TOKYO TANABE CO (JP) | 1998-01-07 | — | — | EP | disclosed |
| US-5677326-A | GASTROINTESTINAL DISORDERS | TOKYO TANABE COMPANY LIMITED (JP) | 1997-10-14 | — | — | US | disclosed |
| EP-0721949-A1 | INDOLINE COMPOUND AND 5-HT 3? RECEPTOR ANTAGONIST CONTAINING THE SAME AS ACTIVE INGREDIENT | TOKYO TANABE COMPANY LIMITED (JP) | 1996-07-17 | — | — | EP | disclosed |