Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 5/20 | 0.36 |
| ▸ | CA2 | P00918 | 5/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 4/20 | 0.34 |
| ▸ | NPC1 | O15118 | 3/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7580989 | 0.80 | ALDH1A1 (0.39) | ALDH1A1TSHRMAPTSMN1; SMN2L3MBTL1 | |
| SCHEMBL7580977 | 0.80 | ALDH1A1 (0.39) | ALDH1A1TSHRMAPTSMN1; SMN2L3MBTL1 | |
| SCHEMBL7571235 | 0.79 | GRIN1 (0.44) | ALDH1A1MAPTSMN1; SMN2LMNAHPGD | |
| SCHEMBL7574435 | 0.79 | AMY1A (0.45) | ALDH1A1TSHRMAPTSMN1; SMN2L3MBTL1 | |
| SCHEMBL11089874 | 0.78 | CA12 (0.57) | ALDH1A1TSHRMAPTSMN1; SMN2L3MBTL1 | |
| SCHEMBL11089873 | 0.78 | CA12 (0.57) | ALDH1A1TSHRMAPTSMN1; SMN2L3MBTL1 | |
| SCHEMBL7581010 | 0.78 | MAPT (0.40) | ALDH1A1MAPTSMN1; SMN2HTTCA12 | |
| SCHEMBL7580866 | 0.78 | GRIN2D (0.44) | ALDH1A1SMN1; SMN2LMNACA2NPC1 | |
| SCHEMBL7575480 | 0.77 | CA12 (0.47) | ALDH1A1MAPTSMN1; SMN2LMNAMAPK1 | |
| SCHEMBL10309895 | 0.76 | ALDH1A1 (0.46) | ALDH1A1TSHRMAPTSMN1; SMN2L3MBTL1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0810199-B1 | Method for producing propargylamine compounds | SUMITOMO CHEMICAL CO (JP) | 2002-09-25 | — | — | EP | disclosed |
| US-5756769-A | Method for producing propargylamine compounds | SUMITOMO CHEMICAL COMPANY, LTD. (JP) | 1998-05-26 | — | — | US | disclosed |
| EP-0810199-A1 | Method for producing propargylamine compounds | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1997-12-03 | — | — | EP | disclosed |