Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.40 |
| ▸ | PIM1 | P11309 | 2/20 | 0.39 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | GSK3B | P49841 | 3/20 | 0.36 |
| ▸ | PRNP | P04156 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.35 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | CASP7 | P55210 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7835174 | 0.83 | MAPT (0.42) | LMNAHPGDRXFP1HSD17B10ALDH1A1 | |
| SCHEMBL7835267 | 0.80 | ALDH1A1 (0.46) | LMNAHPGDGSK3BHSD17B10ALDH1A1 | |
| SCHEMBL7835663 | 0.80 | AHR (0.53) | HPGDCYP1A2CYP2C9CYP2C19HSD17B10 | |
| SCHEMBL7834087 | 0.77 | MPO (0.33) | AHR | |
| SCHEMBL7823203 | 0.76 | AHR (0.52) | HPGDCYP1A2CYP2C9CYP2C19HSD17B10 | |
| SCHEMBL28654053 | 0.76 | PIM1 (0.40) | SIRT1PIM1PIM3LMNAHPGD | |
| SCHEMBL7822873 | 0.76 | AHR (0.51) | HPGDCYP1A2CYP2C9CYP2C19HSD17B10 | |
| SCHEMBL7823266 | 0.74 | MAOA (0.52) | HPGDCYP1A2CYP2C9HSD17B10ALDH1A1 | |
| SCHEMBL3198006 | 0.71 | LMNA (0.51) | PIM1PIM3LMNAHPGDGSK3B | |
| SCHEMBL16920112 | 0.71 | PIM1 (0.46) | PIM1PIM3LMNAHPGDGSK3B |
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 |
|---|---|---|---|---|---|---|---|
| EP-1109813-A1 | PYRROLOINDOLES, PYRIDOINDOLES AND AZEPINOINDOLES AS 5-HT2C AGONISTS | VERNALIS RESEARCH LIMITED (GB) | 2001-06-27 | — | — | EP | disclosed |
| WO-2000012510-A1 | PYRROLOINDOLES, PYRIDOINDOLES AND AZEPINOINDOLES AS 5-HT2C AGONISTS | VERNALIS RESEARCH LIMITED (GB) | 2000-03-09 | — | — | WO | disclosed |