Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE5A | O76074 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.40 |
| ▸ | GCGR | P47871 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | SOAT1 | P35610 | 2/20 | 0.37 |
| ▸ | QPCT | Q16769 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | KCNQ2 | O43526 | 1/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 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 | |
|---|---|---|---|---|
| SCHEMBL7174382 | 0.86 | SMN1; SMN2 (0.42) | IDO1SMN1; SMN2MAPTHTTSOAT1 | |
| SCHEMBL12984545 | 0.85 | SMN1; SMN2 (0.49) | PDE5AIDO1GCGRSMN1; SMN2MAPT | |
| SCHEMBL7186538 | 0.76 | SMN1; SMN2 (0.40) | SMN1; SMN2MAPTKDM4EALDH1A1HPGD | |
| SCHEMBL12984564 | 0.75 | SOAT1 (0.53) | SMN1; SMN2SOAT1QPCTKDM4EALDH1A1 | |
| SCHEMBL27570780 | 0.75 | ALDH1A1 (0.37) | SMN1; SMN2MAPTHTTSOAT1KDM4E | |
| SCHEMBL11512622 | 0.74 | IDO1 (0.55) | PDE5AIDO1MAPTHTTKDM4E | |
| SCHEMBL1726143 | 0.74 | SOAT1 (0.55) | SMN1; SMN2MAPTSOAT1QPCTKDM4E | |
| SCHEMBL9927894 | 0.74 | SOAT1 (0.51) | SMN1; SMN2MAPTSOAT1QPCTALDH1A1 | |
| SCHEMBL25477578 | 0.73 | MAPT (0.55) | PDE5AIDO1GCGRMAPTHTT | |
| SCHEMBL3141420 | 0.72 | KDM1A (0.55) | SMN1; SMN2ALDH1A1LMNA |
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-6576664-B1 | 1-amido-2-hydroxy-substituted-indanes; suppressing production of tumor necrosis factor | BRISTOL-MYERS SQUIBB PHARMA COMPANY | 2003-06-10 | — | — | US | disclosed |