Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | CCR6 | P51684 | 1/20 | 0.45 |
| ▸ | ATM | Q13315 | 1/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | ACACB | O00763 | 1/20 | 0.37 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 4/20 | 0.35 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.35 |
| ▸ | DRD1 | P21728 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | GFER | P55789 | 1/20 | 0.34 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4067061 | 0.90 | ALDH1A1 (0.42) | ALDH1A1HTTKMT2AMEN1LMNA | |
| SCHEMBL4074137 | 0.89 | ALDH1A1 (0.47) | ALDH1A1HTTKMT2AMEN1LMNA | |
| SCHEMBL4072947 | 0.82 | KDM4E (0.40) | KMT2AATMRXRAGRIN1GRIN2B | |
| SCHEMBL4068378 | 0.77 | HTR3E (0.55) | ALDH1A1HTTKMT2AMEN1LMNA | |
| SCHEMBL7074380 | 0.74 | ADRB1 (0.61) | ALDH1A1HTTKMT2AMEN1LMNA | |
| SCHEMBL4067323 | 0.74 | MAPT (0.50) | ALDH1A1HTTKMT2AMEN1LMNA | |
| SCHEMBL4067558 | 0.73 | GALR2 (0.42) | ALDH1A1KMT2AMEN1HPGDGAA | |
| Hydrochloric Acid SCHEMBL7076503 | 0.72 | ADRB1 (0.59) | ALDH1A1HTTKMT2AMEN1LMNA | |
| SCHEMBL4064747 | 0.71 | KDM4E (0.42) | RXRAGRIN1GRIN2BDRD1GALR2 | |
| SCHEMBL28194316 | 0.71 | ALDH1A1 (0.44) | ALDH1A1HTTKMT2AMEN1LMNA |
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-1415986-B1 | SPIRO ISOBENZOFURANES AS NEUROPEPTIDE Y RECEPTOR ANTAGONISTS | BANYU PHARMA CO LTD (JP) | 2009-04-08 | — | — | EP | disclosed |
| US-7205417-B2 | Spiro compounds | BANYU PHARMACEUTICAL CO., LTD. (JP) | 2007-04-17 | — | — | US | disclosed |