Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.40 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.34 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.34 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.34 |
| ▸ | PLAU | P00749 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
| ▸ | NOS1 | P29475 | 2/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7579202 | 0.79 | GRIN2D (0.41) | NPC1SMN1; SMN2MAPTLMNASLC22A2 | |
| SCHEMBL7575165 | 0.79 | GRIN2D (0.41) | SLC22A2SLC22A1SLC22A3PLAUALDH1A1 | |
| SCHEMBL7571861 | 0.79 | CAPN1 (0.41) | KMT2AMAPTLMNAMEN1NPSR1 | |
| SCHEMBL7573612 | 0.79 | MAPT (0.49) | KMT2AMAPTLMNAMEN1NPSR1 | |
| SCHEMBL7572848 | 0.78 | MCL1 (0.46) | SMN1; SMN2KMT2AMAPTLMNAMEN1 | |
| SCHEMBL7573585 | 0.77 | HSD17B3 (0.47) | KMT2AMAPTMEN1NPSR1ALDH1A1 | |
| SCHEMBL7575208 | 0.75 | ALDH1A1 (0.53) | SMN1; SMN2KMT2AMAPTLMNAMEN1 | |
| SCHEMBL7581521 | 0.75 | ALDH1A1 (0.53) | SMN1; SMN2MAPTLMNANPSR1KDM4E | |
| SCHEMBL7571662 | 0.72 | MAPT (0.56) | NPC1SMN1; SMN2MAPTMAPK1PLAU | |
| SCHEMBL7575600 | 0.70 | GRIN2D (0.50) | SMN1; SMN2LMNAKDM4EALDH1A1POLB |
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 |