Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.46 |
| ▸ | GBA1 | P04062 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 3/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.37 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.36 |
| ▸ | HTR3B | O95264 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | HTR3A | P46098 | 1/20 | 0.36 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.36 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.36 |
| ▸ | HTR1A | P08908 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL10944858 | 0.98 | SIGMAR1 (0.44) | SIGMAR1GBA1HIF1ASLC6A4SLC6A2 | |
| SCHEMBL6688133 | 0.89 | SIGMAR1 (0.39) | SIGMAR1GBA1HIF1ASLC6A4SLC6A2 | |
| SCHEMBL11846749 | 0.81 | HIF1A (0.41) | SIGMAR1HIF1AMEN1ALDH1A1TSHR | |
| SCHEMBL1831948 | 0.81 | HIF1A (0.41) | SIGMAR1GBA1HIF1AMEN1ALDH1A1 | |
| SCHEMBL596253 | 0.79 | HIF1A (0.39) | SIGMAR1HIF1AALDH1A1CYP2D6 | |
| SCHEMBL6440687 | 0.78 | HIF1A (0.47) | SIGMAR1GBA1HIF1ASLC6A4SLC6A2 | |
| SCHEMBL8914673 | 0.77 | MEN1 (0.41) | HIF1AMEN1ALDH1A1KMT2A | |
| SCHEMBL1702299 | 0.76 | HIF1A (0.37) | SIGMAR1HIF1AMEN1ALDH1A1CYP2C9 | |
| SCHEMBL7833641 | 0.76 | CHRM3 (0.43) | SIGMAR1GBA1HIF1AMEN1ALDH1A1 | |
| SCHEMBL10841967 | 0.76 | SIGMAR1 (0.59) | SIGMAR1ALDH1A1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| US-6518273-B1 | 2-aryl indole derivative as antagonists of tachykinins | MERCK SHARP & DOHME LTD. | 2003-02-11 | — | — | US | disclosed |