Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | HTT | P42858 | 2/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.48 |
| ▸ | KCNA3 | P22001 | 2/20 | 0.46 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.46 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.46 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.46 |
| ▸ | DRD2 | P14416 | 1/20 | 0.46 |
| ▸ | DRD4 | P21917 | 1/20 | 0.46 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL11994154 | 0.83 | CHRNB2 (0.64) | ALDH1A1HTTTSHRGABRG2GABRB3 | |
| SCHEMBL973933 | 0.77 | ALDH1A1 (0.61) | ALDH1A1HTTL3MBTL1GAASMN1; SMN2 | |
| SCHEMBL10158103 | 0.74 | HTT (0.68) | ALDH1A1HTTTSHRL3MBTL1GAA | |
| SCHEMBL2650829 | 0.73 | MEN1 (0.43) | ALDH1A1HTTTSHRL3MBTL1SMN1; SMN2 | |
| SCHEMBL10844866 | 0.73 | ALDH1A1 (0.65) | ALDH1A1HTTL3MBTL1SMN1; SMN2MEN1 | |
| SCHEMBL4533753 | 0.73 | ALDH1A1 (0.69) | ALDH1A1HTTL3MBTL1SMN1; SMN2ALOX15 | |
| SCHEMBL27634042 | 0.73 | ALDH1A1 (0.81) | ALDH1A1HTTL3MBTL1SMN1; SMN2MEN1 | |
| SCHEMBL1927649 | 0.72 | DRD2 (0.77) | ALDH1A1L3MBTL1GAADRD2DRD4 | |
| SCHEMBL1156350 | 0.72 | ALDH1A1 (0.59) | ALDH1A1HTTTSHRL3MBTL1GABRG2 | |
| SCHEMBL4042415 | 0.72 | TSHR (0.58) | ALDH1A1TSHRGAASMN1; SMN2ALOX15 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2006110918-A1 | PYRROLE COMPOUNDS AND USES THEREOF | AMBIT BIOSCIENCES CORPORATION (US) | 2006-10-19 | — | — | WO | claimed |